Consensus flow list

Identity

Type
Neutral molecule
CAS
75-60-5
EC
200-883-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Dimethylarsinic acid

Alternative labels

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string OGGXGZAMXPVRFZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C2H7AsO2/c1-3(2,4)5/h1-2H3,(H,4,5)
IUPAC name chemrof:IUPAC_name Dimethylarsinic acid
Molecular formula chemrof:molecular_formula C2H7AsO2
Molecular mass chemrof:molecular_mass 137.998
Monoisotopic mass chemrof:monoisotopic_mass 137.9662, 137.966201
SMILES string chemrof:smiles_string C[As](C)(=O)O

Known URLs

33

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
beilstein beilstein:1736965 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=75-60-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:48765 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.804 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7020508 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB02994 enrich_references.pubchem_identifier_url
drugcentral drugcentral:3058 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/3058 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=103115 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=71159 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1231644 enrich_references.pubchem_identifier_url
gmelin gmelin:130562 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/AJ2HL7EU8K enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0011625 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.395G enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07308 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07308 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=147540 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C80595 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:CAD enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL1231644 enrich_references.pubchem_identifier_url
ppdb ppdb:2879 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/2513 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1572 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=019823 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/11379771 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11549254 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21342701 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21457993 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21608259 enrich_references.chebi_xrefs
reaxys reaxys:1736965 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q420680 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Cacodylic_acid enrich_references.chebi_xrefs

Elementary flows

14
Flow Context Source Unit CFs
e2fa8f88-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
08a91e70-3ddc-11dd-9b2e-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
073ec793-b028-49c1-a735-781ec752af99 Environmental → Air → Indoor EF 3.1 kg 4
08a91e70-3ddc-11dd-9b2d-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9b2f-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
08a91e70-3ddc-11dd-9b2c-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
08a91e70-3ddc-11dd-9b2a-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
fe0acd60-3ddc-11dd-a097-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
1a7b6c530277bd99ce23a27ab9f0635bc519b8b0 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-9b2b-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a095-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-ae43-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
fe0acd60-3ddc-11dd-a094-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
fe0acd60-3ddc-11dd-a096-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-422532320ee54a75",
  "prefLabel": [
    {
      "@value": "Dimethylarsinic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "[As(CH3)2O(OH)]",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Arsan",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=75-60-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Arsine oxide, hydroxydimethyl-",
      "@language": "en",
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        ],
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    },
    {
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      "@language": "en",
      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "Arsinic acid, dimethyl-",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "As,As-Dimethylarsinic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Cacodylic Acid",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "original name retained as altLabel"
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    },
    {
      "@value": "Dimethylarsenic acid",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dimethylarsinate",
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      }
    },
    {
      "@value": "Hydroxydimethylarsine oxide",
      "@language": "en",
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    },
    {
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    },
    {
      "@value": "Me2As(=O)OH",
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    },
    {
      "@value": "Phytar",
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    },
    {
      "@value": "Sylvicor",
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