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Sodium 3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate

UUID 553f4e3b-84aa-4b36-8ad0-c520eace1117
Flow Object IDfo-056a00a97920ae9e
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 102601-34-3
EC Numbers 700-631-8
prefLabel
Language Value Provenance
en Sodium 3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate
altLabel ⓘ
Language Value Provenance
en 1-Propanesulfonic acid, 3-(cyclohexylamino)-2-hydroxy-, monosodium salt
en 1-Propanesulfonic acid, 3-(cyclohexylamino)-2-hydroxy-, sodium salt (1:1)
References
Shared Properties
Predicate Value
InChIKey CLEVULOKVPBHCU-VIFPVBQESA-M, GGPORGHJKBOGDV-UHFFFAOYSA-M, SPWKBIUYKDBPGP-UHFFFAOYSA-N
InChI InChI=1S/C9H13NO4S/c11-9(7-15(12,13)14)6-10-8-4-2-1-3-5-8/h1-5,9-11H,6-7H2,(H,12,13,14)/p-1/t9-/m0/s1, InChI=1S/C9H19NO4S.Na/c11-9(7-15(12,13)14)6-10-8-4-2-1-3-5-8;/h8-11H,1-7H2,(H,12,13,14);, InChI=1S/C9H19NO4S.Na/c11-9(7-15(12,13)14)6-10-8-4-2-1-3-5-8;/h8-11H,1-7H2,(H,12,13,14);/q;+1/p-1
IUPAC name (2S)-2-oxidanyl-3-phenylazanyl-propane-1-sulfonate, (2S)-3-anilino-2-hydroxy-1-propanesulfonate, (2S)-3-anilino-2-hydroxy-propane-1-sulfonate, (2S)-3-anilino-2-hydroxypropane-1-sulfonate, sodium 3-(cyclohexylamino)-2-hydroxy-1-propanesulfonate, sodium 3-(cyclohexylamino)-2-hydroxy-propane-1-sulfonate, sodium 3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate, sodium 3-(cyclohexylamino)-2-oxidanyl-propane-1-sulfonate
Molecular formula C9H12NO4S-, C9H18NNaO4S, C9H19NNaO4S
SMILES C1=CC=C(C=C1)NCC(CS(=O)(=O)[O-])O, C1=CC=C(C=C1)NC[C@@H](CS(=O)(=O)[O-])O, C1CCC(CC1)NCC(CS(=O)(=O)O)O.[Na], C1CCC(CC1)NCC(CS(=O)(=O)[O-])O.[Na+]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 553f4e3b-84aa-4b36-8ad0-c520eace1117 sodium 3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 sodium 3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate Emissions/Emissions to water/Emissions to fresh water kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=sodium3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate||dimension=Environmental > media=Air > strata=Unknown; cas=102601-34-3; added Common Chemistry CAS names as altLabel: 1-Propanesulfonic acid, 3-(cyclohexylamino)-2-hydroxy-, monosodium salt, 1-Propanesulfonic acid, 3-(cyclohexylamino)-2-hydroxy-, sodium salt (1:1); object_uuid=fo-056a00a97920ae9e
cas_match_labels 1 — consensus_match group_key=sodium3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'102601-34-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-056a00a97920ae9e: {'102601-34-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
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cas_match_labels None {'102601-34-3': 'exactMatch'} group_key=sodium3-(cyclohexylamino)-2-hydroxypropane-1-sulfonate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'102601-34-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-056a00a97920ae9e: {'102601-34-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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