Consensus flow list

Identity

Type
Neutral molecule
CAS
7087-68-5
EC
230-392-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N-ethyl-n-isopropylpropan-2-amine

Alternative labels

19

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string JGFZNNIVVJXRND-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3
IUPAC name chemrof:IUPAC_name N-ethyl-N-propan-2-ylpropan-2-amine
Molecular formula chemrof:molecular_formula C8H19N
Molecular mass chemrof:molecular_mass 129.247
Monoisotopic mass chemrof:monoisotopic_mass 129.15175
SMILES string chemrof:smiles_string CCN(C(C)C)C(C)C

Known URLs

12

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=7087-68-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:193590 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.027.629 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.73565.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8064561 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=147491 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5SIQ15721L enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0247306 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J108.742H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/81531 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q306946 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/N,N-Diisopropylethylamine enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
33c6f4ab-bcce-4644-b075-b43c3745c99a Environmental → Air → Aircraft cruise height EF 3.1 kg 4
3160278f-bcc1-4b2e-bdbf-8631227e1b71 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
9f4f3e7a-684d-4afd-9407-a222bab27526 Environmental → Air → Indoor EF 3.1 kg 4
88436882-287d-42dd-8674-c7aaefeb9588 Environmental → Air → Long-term EF 3.1 kg 0
4245b972-65ba-4e2c-a050-24578a36af2b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
15630f53-5c6e-4a45-9867-288288a8e55d Environmental → Air → Unknown EF 3.1 kg 4
c02f108a-f125-429c-8179-095f585c11eb Environmental → Ground → Agricultural EF 3.1 kg 4
2937b6c7-b87c-4f95-9130-39beddab9d0d Environmental → Ground → Non-agricultural EF 3.1 kg 4
73d3fc0e-d2b4-46d6-b0a8-40305f468810 Environmental → Ground → Unknown EF 3.1 kg 4
797735e4-6cd9-470a-9f15-eae7b53794cd Environmental → Water → Long-term EF 3.1 kg 0
5fb62517-69b5-4439-ae8d-06d8687783ad Environmental → Water → Ocean EF 3.1 kg 4
6568aa02-9d36-4dfe-a931-fd5fb0f7cc1d Environmental → Water → Surface water EF 3.1 kg 4
2e17e4e1-6571-4b3a-8761-b308d858a13e 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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