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CHEBI:32879 - propane

Default Structure
ChEBI IDCHEBI:32879
ChEBI Namepropane
Stars
Last Modified13 October 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC3H8
Net Charge0
Average Mass44.097
Monoisotopic Mass44.06260
SMILESCCC
InChIInChI=1S/C3H8/c1-3-2/h3H2,1-2H3
InChIKeyATUOYWHBWRKTHZ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
food propellant  A propellant that is used to expel foods from an aerosol container.
Biological Role:
food propellant  A propellant that is used to expel foods from an aerosol container.
Application:
food propellant  A propellant that is used to expel foods from an aerosol container.
ChEBI Ontology
Outgoing Relation(s)
propane (CHEBI:32879) has role food propellant (CHEBI:78017)
propane (CHEBI:32879) is a alkane (CHEBI:18310)
propane (CHEBI:32879) is a gas molecular entity (CHEBI:138675)
Incoming Relation(s)
1-chloropropan-2-ol (CHEBI:76260) has parent hydride propane (CHEBI:32879)
1-nitropropane (CHEBI:76261) has parent hydride propane (CHEBI:32879)
1,3-diiodopropane (CHEBI:760844) has parent hydride propane (CHEBI:32879)
octafluoropropane (CHEBI:31980) has parent hydride propane (CHEBI:32879)
propanesulfenic acid (CHEBI:91018) has parent hydride propane (CHEBI:32879)
isopropyl group (CHEBI:30353) is substituent group from propane (CHEBI:32879)
propyl group (CHEBI:26308) is substituent group from propane (CHEBI:32879)
propylidene group (CHEBI:65236) is substituent group from propane (CHEBI:32879)
trimethylene group (CHEBI:45887) is substituent group from propane (CHEBI:32879)
IUPAC Name 
propane
Synonyms  Source
A-108ChEMBL
CH3‒CH2‒CH3IUPAC
E-944ChEMBL
E944ChEBI
INS-944ChEMBL
INS NO.944ChEMBL
UniProt Name  Source
propaneUniProt
Registry NumbersSources
Beilstein:1730718Beilstein
Gmelin:25044Gmelin
CAS:74-98-6ChemIDplus
CAS:74-98-6NIST Chemistry WebBook
Citations