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Calcium Dihydrogen Phosphate

fo-e9d75e01c367e3af

Identity

Type
Chemical salt
CAS
7758-23-8
EC
231-837-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Calcium Dihydrogen Phosphate

What it is used for

2

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
fertilizer CHEBI:33287 A fertilizer is any substance that is added to soil or water to assist the growth of plants. ChEBI

Alternative labels

31

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YYRMJZQKEFZXMX-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string InChI=1S/Ca.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2
IUPAC name chemrof:IUPAC_name Calcium Dihydrogen Phosphate
Molecular formula chemrof:molecular_formula Ca.2H2O4P, CaH4O8P2, H4CaO8P2
Molecular mass chemrof:molecular_mass 234.05
Monoisotopic mass chemrof:monoisotopic_mass 233.90073, 233.900731
SMILES string chemrof:smiles_string O=P([O-])(O)O.O=P([O-])(O)O.[Ca+2]

Known URLs

12

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=7758-23-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:35433 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.120.428 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2044262 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/701EKV9RMN enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C13556 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C13556 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/24454 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1426444 enrich_references.pubchem_identifier_url
Wikidata https://www.wikidata.org/wiki/Q414673 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Calcium_phosphate enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Monocalcium_phosphate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
59a6d672-cd32-4768-9af9-86b696516773 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
60abc0b3-f374-4ba4-8043-73c8c21821dd Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
c8fb3eeb-ea21-4835-a571-2f1cafc1a27c Environmental → Air → Indoor EF 3.1 kg 4
45728a90-1c49-4c3a-9c96-8291835f5e73 Environmental → Air → Long-term EF 3.1 kg 0
4aa049b3-a36d-42dd-a266-2173fee32253 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
9d19314a-e413-43e2-a081-2d3016481107 Environmental → Air → Unknown EF 3.1 kg 4
293fafeb-553a-492b-b95e-c9f7c08238df Environmental → Ground → Agricultural EF 3.1 kg 4
7161cb91-1237-4da8-90be-b2a21288b3e3 Environmental → Ground → Non-agricultural EF 3.1 kg 4
d472c2df-e2cd-4514-b00d-2c82c9bb1716 Environmental → Ground → Unknown EF 3.1 kg 4
dd0baea6-ff99-458e-8505-58ecaa4fd131 Environmental → Water → Long-term EF 3.1 kg 0
d41a47d9-69d2-430f-a34a-544f18ac5fa4 Environmental → Water → Ocean EF 3.1 kg 4
3f67c7ee-2909-4fb1-8ded-0681ff674cc0 Environmental → Water → Surface water EF 3.1 kg 4
10344f95-9a7d-4da9-ab0a-99f81e6acfe6 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-e9d75e01c367e3af",
  "prefLabel": [
    {
      "@value": "Calcium Dihydrogen Phosphate",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "acid calcium phosphate",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Ca(H2PO4)2",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Calcium biphosphate",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "calcium bis(dihydrogen phosphate)",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "calcium bis(dihydrogenphosphate)",
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      }
    },
    {
      "@value": "Calcium bis(orthophosphate)",
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    {
      "@value": "calcium dihydrogen orthophosphate",
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    },
    {
      "@value": "Calcium diorthophosphate",
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      }
    },
    {
      "@value": "Calcium hydride phosphate",
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      "@value": "Calcium hydrogen phosphate (Ca(H2PO4)2)",
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    },
    {
      "@value": "Calcium hydrogen phosphate (CaH4(PO4)2)",
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        ],
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      }
    },
    {
      "@value": "Calcium monobasic phosphate",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Calcium orthophosphate monobasic",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium phosphate (1:2)",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium phosphate (Ca(H2PO4)2)",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium phosphate (CaH4(PO4)2)",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium phosphate monobasic",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium phosphate, primary",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium primary phosphate",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "calcium superphosphate",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Calcium tetrahydrogen orthophosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=7758-23-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Calcium tetrahydrogen phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=7758-23-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "HT Monocalcium Phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Monobasic calcium phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "http://purl.obolibrary.org/obo/CHEBI_35433"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Monocalcium dihydrogen phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:7758-23-8",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=7758-23-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "monocalcium orthophosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Monocalcium phosphate (Ca(H2PO4)2)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=7758-23-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Monocalcium phosphate [CaH4(PO4)2]",
      "@language": "en",
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      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=7758-23-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "monocalcium phosphate, monobasic",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "phosphoric acid, calcium salt (2:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "primary calcium phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    }
  ],
  "properties": {
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        "Ca.2H2O4P",
        "CaH4O8P2",
        "H4CaO8P2"
      ],
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        "H4CaO8P2": [
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    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/Ca.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2"
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