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N-isopropyl-2-methylacrylamide

fo-ba4816afbbd027d2

Identity

Type
Neutral molecule
CAS
13749-61-6
EC
237-331-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N-isopropyl-2-methylacrylamide

Alternative labels

7

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string YQIGLEFUZMIVHU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H13NO/c1-5(2)7(9)8-6(3)4/h6H,1H2,2-4H3,(H,8,9)
IUPAC name chemrof:IUPAC_name N-isopropyl-2-methylacrylamide
Molecular formula chemrof:molecular_formula C7H13NO
Molecular mass chemrof:molecular_mass 127.187
Monoisotopic mass chemrof:monoisotopic_mass 127.099714
SMILES string chemrof:smiles_string C=C(C)C(=O)NC(C)C

Known URLs

8

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=13749-61-6 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=66004-95-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.033.923 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID50160204 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/32216XNO4Q enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J278.030E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/83698 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27256119 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
c6b96104-3ec5-46e7-b557-acf1403b2c99 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
1a63f257-e04e-4b8e-9590-e59ff232fbdd Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d9a5b918-a287-4ba7-9dab-dec4806ef98b Environmental → Air → Indoor EF 3.1 kg 4
9e22c548-a8df-49ac-b455-a3c5acdc37fd Environmental → Air → Long-term EF 3.1 kg 0
94b31fba-0d78-4d26-8429-68af3c532dc8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
6b4f8c65-0e5b-4528-97b5-45ee1dc7d9e1 Environmental → Air → Unknown EF 3.1 kg 4
ea9fccf4-56fc-4fdb-b782-9af0d499ca20 Environmental → Ground → Agricultural EF 3.1 kg 4
5bc4cc26-3800-49c4-bc84-58d00112ba70 Environmental → Ground → Non-agricultural EF 3.1 kg 4
fa8f7780-6238-404c-95f6-401ab6d83751 Environmental → Ground → Unknown EF 3.1 kg 4
85b64244-5a4b-4db0-8743-14120aa15c09 Environmental → Water → Long-term EF 3.1 kg 0
068d4110-b827-4887-988b-0c9f2e2b39af Environmental → Water → Ocean EF 3.1 kg 4
15797fad-83ab-422d-86fd-76042d4008c8 Environmental → Water → Surface water EF 3.1 kg 4
322075e6-6a77-4551-9291-d199b50ea0c1 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-ba4816afbbd027d2",
  "prefLabel": [
    {
      "@value": "N-isopropyl-2-methylacrylamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Methyl-N-(1-methylethyl)-2-propenamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:13749-61-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=13749-61-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methyl-N-(propan-2-yl)prop-2-enamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:13749-61-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=13749-61-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methyl-N-propan-2-ylprop-2-enamide",
      "@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=13749-61-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Propenamide, 2-methyl-N-(1-methylethyl)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=13749-61-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Acrylamide, N-isopropyl-2-methyl-",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N-Isopropylmethacrylamide",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "NIPMAM",
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  "properties": {
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      "attested_by": {
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    "https://w3id.org/chemrof/molecular_mass": {
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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  },
  "references": [
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  "classifications": {
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  "@type": [
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  ]
}

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