Consensus flow list

3-aminomethyl-3,5,5-trimethylcyclohexylamine

fo-97146c4abea560b4

Identity

Type
NeutralMolecule
CAS
2855-13-2
EC
220-666-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 3-aminomethyl-3,5,5-trimethylcyclohexylamine

Alternative labels

37

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string RNLHGQLZWXBQNY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H22N2/c1-9(2)4-8(12)5-10(3,6-9)7-11/h8H,4-7,11-12H2,1-3H3
IUPAC name chemrof:IUPAC_name 3-aminomethyl-3,5,5-trimethylcyclohexylamine
Molecular formula chemrof:molecular_formula C10H22N2
Molecular mass chemrof:molecular_mass 170.3
Monoisotopic mass chemrof:monoisotopic_mass 170.178299
SMILES string chemrof:smiles_string CC1(C)CC(N)CC(C)(CN)C1

Known URLs

10

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=2855-13-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.018.788 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0498 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6027503 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1876029 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J68.532A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/17857 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2289 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q1674522 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Isophorone_diamine enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bbe8d761-40f0-4d86-b739-c1a98010c829 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
a21a9d19-a738-4e43-af8e-9821e5670593 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d6256963-aaa5-4e5b-baa4-034a4d053ca8 Environmental → Air → Indoor EF 3.1 kg 4
7eb29982-4056-4204-aab6-79042b20f974 Environmental → Air → Long-term EF 3.1 kg 0
bf4eb5a5-bb13-4cb5-9048-3767d62e8397 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
dec4d26e-4303-4d4f-a4ba-3746eff8a8a2 Environmental → Air → Unknown EF 3.1 kg 4
77c8c5c8-29e2-4420-9e7c-cf4db098e74a Environmental → Ground → Agricultural EF 3.1 kg 4
c08e9d4f-fb69-4919-b581-1481474f9122 Environmental → Ground → Non-agricultural EF 3.1 kg 4
3da18d6f-a681-4c8b-afce-ccc3fa4a0981 Environmental → Ground → Unknown EF 3.1 kg 4
016e6d5f-716b-4a4c-b2fd-4f8e417d8884 Environmental → Water → Long-term EF 3.1 kg 0
b87a73f4-ecbc-4941-b010-fd696e66e891 Environmental → Water → Ocean EF 3.1 kg 4
ba3145fa-5d95-455d-b175-38ee40f37f1d Environmental → Water → Surface water EF 3.1 kg 4
343b0a0d-60ec-4d35-bc3e-afd9fa046ab2 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 
{
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      "@value": "Docure KH 816",
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      "@value": "Epilox IPD",
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    },
    {
      "@value": "IPD",
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      "@value": "IPDA",
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    },
    {
      "@value": "Isophorondiamine",
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    },
    {
      "@value": "Isophorone diamine",
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    {
      "@value": "Luxam IPD",
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      "@value": "Nitoprime 25 Hardener",
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      "@value": "Polypox IPD",
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      "@value": "Surf Clear SCD",
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      "@value": "Wanamine IPDA",
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  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
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