Consensus flow list

Identity

Type
Neutral molecule
CAS
84988-61-4
EC
284-851-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for Isononyl Alcohol, Phosphated

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string IDXWQJNXMQJTCW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H21O4P/c1-9(2)7-5-3-4-6-8-13-14(10,11)12/h9H,3-8H2,1-2H3,(H2,10,11,12)
IUPAC name chemrof:IUPAC_name 7-methyloctyl dihydrogen phosphate
Molecular formula chemrof:molecular_formula C9H21O4P
Molecular mass chemrof:molecular_mass 224.237
Monoisotopic mass chemrof:monoisotopic_mass 224.117746
SMILES string chemrof:smiles_string CC(C)CCCCCCOP(=O)(O)O

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=27253-57-2 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=84988-61-4 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.043.965 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.077.109 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID70234032 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2JPZ4GIZ0A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/19800828 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27254836 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
8364dc9b-bb2a-4e16-a964-21c29d3897bf Environmental → Air → Aircraft cruise height EF 3.1 kg 4
e919caae-7232-479d-b9f8-e15049757398 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
27c08d4a-fea0-4956-bced-e4974881116d Environmental → Air → Indoor EF 3.1 kg 4
adb3e738-e7d7-4d64-b0a2-83b0858a0111 Environmental → Air → Long-term EF 3.1 kg 0
6eb82ff2-45da-4925-80e7-110ef37199b4 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
f9387fa8-1686-4f04-9079-e258050d272d Environmental → Air → Unknown EF 3.1 kg 4
13b3cfdd-a378-4e2b-9aca-87c9137a09bc Environmental → Ground → Agricultural EF 3.1 kg 4
f3292da3-7736-45ec-bd3f-6f122cece469 Environmental → Ground → Non-agricultural EF 3.1 kg 4
0c7e0052-e311-4325-a455-ee1181b59ff7 Environmental → Ground → Unknown EF 3.1 kg 4
43a982ae-5bc8-42fb-b018-d33764ed0dd0 Environmental → Water → Long-term EF 3.1 kg 0
1f8475e4-2c61-4405-8038-7c683b1040f2 Environmental → Water → Ocean EF 3.1 kg 4
be5aa150-ab67-4a05-bad1-16959a65c0ff Environmental → Water → Surface water EF 3.1 kg 4
84acddf7-b07c-4b16-ae2b-b5c57fd9a1a4 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-300c910919fdda43",
  "prefLabel": [
    {
      "@value": "Isononyl Alcohol, Phosphated",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Isononyl dihydrogen phosphate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
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      }
    },
    {
      "@value": "Marlophor ND Acid",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phosphoric acid, isononyl ester",
      "@language": "en",
      "@lang": "en",
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      "@language": "en",
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}

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