Consensus flow list

Identity

Type
Neutral molecule
CAS
6318-09-8
EC
613-175-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2,4,6-tris(propan-2-yl)benzene-1,3-diamine

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UCUPHRPMBXOFAU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H26N2/c1-8(2)11-7-12(9(3)4)15(17)13(10(5)6)14(11)16/h7-10H,16-17H2,1-6H3
IUPAC name chemrof:IUPAC_name 2,4,6-tris(propan-2-yl)benzene-1,3-diamine
Molecular formula chemrof:molecular_formula C15H26N2
Molecular mass chemrof:molecular_mass 234.387
Monoisotopic mass chemrof:monoisotopic_mass 234.209599
SMILES string chemrof:smiles_string CC(C)c1cc(C(C)C)c(N)c(C(C)C)c1N

Known URLs

7

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=6318-09-8 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.116.716 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID10282890 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=28619 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/EH9X4S9JUJ enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/231851 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q82017277 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
fec13aa6-cd10-4548-8742-7aaafec14558 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
043f4b32-46e5-4949-bfa2-37bc65cab457 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
3fbf3fef-fa11-44b6-a2a4-7129d11ceb6e Environmental → Air → Indoor EF 3.1 kg 2
f8b204b0-d55f-40e4-9282-97ce12a65bb3 Environmental → Air → Long-term EF 3.1 kg 0
f462bb67-d98b-4378-b163-32a436d75b2e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
72efad5a-da69-4605-ada9-0f856d3962f6 Environmental → Air → Unknown EF 3.1 kg 2
03d96cd9-2586-4705-b227-13da5dd34489 Environmental → Ground → Agricultural EF 3.1 kg 2
d6290590-62b1-4a43-833d-dbdeaee31285 Environmental → Ground → Non-agricultural EF 3.1 kg 2
7c005bf8-e867-4b94-83a7-1159cdadca30 Environmental → Ground → Unknown EF 3.1 kg 2
8792721b-6d7d-4cf9-98d9-7bdfe018e778 Environmental → Water → Long-term EF 3.1 kg 0
68a0ee3d-a061-44a2-85c0-332a69356212 Environmental → Water → Ocean EF 3.1 kg 2
279e8e11-c3b4-4244-9c1d-1c64c28116ac Environmental → Water → Surface water EF 3.1 kg 2
de14f95e-124e-4236-a173-9c3fe107b013 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-d24c689277c3f260",
  "prefLabel": [
    {
      "@value": "2,4,6-tris(propan-2-yl)benzene-1,3-diamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,3-Benzenediamine, 2,4,6-tris(1-methylethyl)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=6318-09-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,3-Diamino-2,4,6-triisopropylbenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4,6-Triisopropyl-1,3-benzenediamine",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4,6-Tris(1-methylethyl)-1,3-benzenediamine",
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    },
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}

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