EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28831 - propan-1-ol

Default Structure
ChEBI IDCHEBI:28831
ChEBI Namepropan-1-ol
Stars
DefinitionThe parent member of the class of propan-1-ols that is propane in which a hydrogen of one of the methyl groups is replaced by a hydroxy group.
Secondary ChEBI IDsCHEBI:8472, CHEBI:26278, CHEBI:44960
Last Modified24 April 2024
DownloadsMolfile
FormulaC3H8O
Net Charge0
Average Mass60.096
Monoisotopic Mass60.05751
SMILESCCCO
InChIInChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChIKeyBDERNNFJNOPAEC-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
protic solvent  A polar solvent that is capable of acting as a hydron (proton) donor.
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
protic solvent  A polar solvent that is capable of acting as a hydron (proton) donor.
ChEBI Ontology
Outgoing Relation(s)
propan-1-ol (CHEBI:28831) has role metabolite (CHEBI:25212)
propan-1-ol (CHEBI:28831) has role protic solvent (CHEBI:48356)
propan-1-ol (CHEBI:28831) is a propan-1-ols (CHEBI:26279)
propan-1-ol (CHEBI:28831) is a short-chain primary fatty alcohol (CHEBI:157770)
Incoming Relation(s)
3-methylthiopropanol (CHEBI:49019) has functional parent propan-1-ol (CHEBI:28831)
3-nitropropan-1-ol (CHEBI:49042) has functional parent propan-1-ol (CHEBI:28831)
propamocarb (CHEBI:82033) has functional parent propan-1-ol (CHEBI:28831)
propyl acetate (CHEBI:40116) has functional parent propan-1-ol (CHEBI:28831)
propyl butyrate (CHEBI:89719) has functional parent propan-1-ol (CHEBI:28831)
propyl decanoate (CHEBI:86973) has functional parent propan-1-ol (CHEBI:28831)
propyl hexanoate (CHEBI:87365) has functional parent propan-1-ol (CHEBI:28831)
propyl propionate (CHEBI:89828) has functional parent propan-1-ol (CHEBI:28831)
propylparaben (CHEBI:32063) has functional parent propan-1-ol (CHEBI:28831)
4,5,6,7-tetrachloro-2-benzofuran-1(3H)-one (CHEBI:47617) is a propan-1-ol (CHEBI:28831)
propoxy group (CHEBI:46881) is substituent group from propan-1-ol (CHEBI:28831)
IUPAC Name 
propan-1-ol
Synonyms  Source
1-HydroxypropaneKEGG COMPOUND
1-PropanolKEGG COMPOUND
n-propan-1-olChemIDplus
n-PropylalkoholChEBI
ethyl carbinolChemIDplus
EthylcarbinolKEGG COMPOUND
UniProt Name  Source
1-propanolUniProt
Manual XrefsDatabases
4332DrugCentral
C05979KEGG COMPOUND
DB03175DrugBank
HMDB0000820HMDB
POLPDBeChem
Propan-1-olWikipedia
Registry NumbersSources
Reaxys:1098242Reaxys
Gmelin:25616Gmelin
CAS:71-23-8NIST Chemistry WebBook
CAS:71-23-8ChemIDplus
CAS:71-23-8KEGG COMPOUND
Citations