Consensus flow list

Identity

Type
Molecular complex
CAS
3323-53-3
EC
222-037-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Adipic Acid, Compound With Hexane-1,6-diamine (1:1)

Alternative labels

16

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UFFRSDWQMJYQNE-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H16N2.C6H10O4/c7-5-3-1-2-4-6-8;7-5(8)3-1-2-4-6(9)10/h1-8H2;1-4H2,(H,7,8)(H,9,10)
IUPAC name chemrof:IUPAC_name Adipic Acid, Compound With Hexane-1,6-diamine (1:1)
Molecular formula chemrof:molecular_formula C12H26N2O4
Molecular mass chemrof:molecular_mass 262.35
Monoisotopic mass chemrof:monoisotopic_mass 262.189257
SMILES string chemrof:smiles_string NCCCCCCN.O=C(O)CCCCC(=O)O

Known URLs

11

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=15511-81-6 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=3323-53-3 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=52349-42-5 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=69227-16-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.020.035 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.035.930 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8027533 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/HC756O198H enrich_references.pubchem_identifier_url
hts.usitc.gov https://hts.usitc.gov/search?query=2921.22.05.00 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/197024 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q1616660 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
318ecbca-6524-488c-b261-1f59b9683d41 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
30b5e665-148e-4af8-baa7-58e6b7541cc9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
e10f6e7b-38f5-4ae2-919b-30cf578ac1dc Environmental → Air → Indoor EF 3.1 kg 4
63d65eed-4771-48ea-91fe-3d5a6a788e7a Environmental → Air → Long-term EF 3.1 kg 0
d76df769-567e-4e1a-82cb-3b53751db2ba Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
796760f0-a078-4416-b815-959a3c6c83cc Environmental → Air → Unknown EF 3.1 kg 4
eb8ac890-8609-4b03-9e4a-a70c36929650 Environmental → Ground → Agricultural EF 3.1 kg 4
426d0be9-4dc9-4bf7-9d1f-95e80b495c0f Environmental → Ground → Non-agricultural EF 3.1 kg 4
24e7dc7d-f100-490a-99b4-07e0ee6e491f Environmental → Ground → Unknown EF 3.1 kg 4
1bce1a8e-3a0e-4699-b673-82f810d91a55 Environmental → Water → Long-term EF 3.1 kg 0
19b6edcd-a95d-4172-a4a2-b4c024d7d787 Environmental → Water → Ocean EF 3.1 kg 4
d5052d94-4de2-4d3e-89d6-5f8b99268d25 Environmental → Water → Surface water EF 3.1 kg 4
3de397be-6884-46d9-a57c-0b8a88a90e1f 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
{
  "flow_object_id": "fo-fd7d71e3e31e9efd",
  "prefLabel": [
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  ],
  "altLabel": [
    {
      "@value": "1,6-Hexanediamine, adipate (1:1)",
      "@language": "en",
      "@lang": "en",
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    },
    {
      "@value": "1,6-Hexanediamine, hexanedioate (1:1)",
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    },
    {
      "@value": "Adipic acid hexamethylenediamine salt",
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    {
      "@value": "Hexamethylenediammonium adipate",
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    },
    {
      "@value": "Nylon 66 salt",
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    },
    {
      "@value": "Salt AG",
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    {
      "@value": "Sel Nylon-AH salt",
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  "properties": {
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