Brightway Flows 1.0
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α-Terpinene

fo-5748876447bc993f

Identity

Type
Neutral molecule
CAS
99-86-5
EC
202-795-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for α-Terpinene

Alternative labels

11

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YHQGMYUVUMAZJR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8H,5,7H2,1-3H3
IUPAC name chemrof:IUPAC_name α-Terpinene
Molecular formula chemrof:molecular_formula C10H16
Molecular mass chemrof:molecular_mass 136.238
Monoisotopic mass chemrof:monoisotopic_mass 136.1252, 136.125201
SMILES string chemrof:smiles_string CC1=CC=C(C(C)C)CC1

Known URLs

29

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
bpdb bpdb:2014 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=99-86-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:10334 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.541 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9041237 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2251642 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/p-mentha-13-diene enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/I24X278AP1 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0036995 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.975A enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C09898 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C09898 enrich_references.pubchem_identifier_url
knapsack knapsack:C00003060 enrich_references.chebi_xrefs
LIPID MAPS https://www.lipidmaps.org/databases/lmsd/LMPR0102090026 enrich_references.chebi_xrefs
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMPR0102090026 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=28114 enrich_references.pubchem_identifier_url
patent patent:WO2010099985 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7462 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=548091 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/15621337 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16780354 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/20387784 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22164802 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23833899 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24020201 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/8655097 enrich_references.chebi_xrefs
reaxys reaxys:1853379 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q423851 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Terpinene enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
e936198f-5a39-4a67-bb30-143a75ffacd9 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
6347bdbe-5b97-4e8e-bf6e-26eb85c88d90 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
bd603aca-5ce9-4515-b47b-fcfa23d15599 Environmental → Air → Indoor EF 3.1 kg 2
3000e986-737b-4ebe-b082-4ec36005f266 Environmental → Air → Long-term EF 3.1 kg 0
671239d4-6428-4e74-8d6a-c01b515fd319 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
be88088b-40a0-44a9-b359-fac9b6212b9f Environmental → Air → Unknown EF 3.1 kg 2
5da33cf5-899f-4034-bac3-c0769104cd19 Environmental → Ground → Agricultural EF 3.1 kg 2
d2691ec8-d442-429d-81f8-8138c296a627 Environmental → Ground → Non-agricultural EF 3.1 kg 2
887aff39-08fa-4df1-9cf3-aa40f5d39d39 Environmental → Ground → Unknown EF 3.1 kg 2
cdacbf99-af56-44a4-9628-317a431bfce2 Environmental → Water → Long-term EF 3.1 kg 0
2a803c96-249f-4bee-b540-54fe071a9417 Environmental → Water → Ocean EF 3.1 kg 2
e27b9f23-2b41-4941-b3b5-90e3e21ba950 Environmental → Water → Surface water EF 3.1 kg 2
614ccacf-ecdc-4e1a-922d-9c1669a2ecd0 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
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