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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:28831 - propan-1-ol
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ChEBI Ontology
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ChEBI Name
propan-1-ol
ChEBI ID
CHEBI:28831
Definition
The 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.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:44960, CHEBI:8472, CHEBI:26278
Supplier Information
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Read full article at Wikipedia
Formula
C3H8O
Net Charge
0
Average Mass
60.09500
Monoisotopic Mass
60.05751
InChI
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChIKey
BDERNNFJNOPAEC-UHFFFAOYSA-N
SMILES
CCCO
Roles Classification
Chemical Role
(s):
protic solvent
A polar solvent that is capable of acting as a hydron (proton) donor.
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application
(s):
protic solvent
A polar solvent that is capable of acting as a hydron (proton) donor.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
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
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(3
H
)-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
Sources
1-Hydroxypropane
KEGG COMPOUND
1-Propanol
KEGG COMPOUND
1-propanol
UniProt
ethyl carbinol
ChemIDplus
Ethylcarbinol
KEGG COMPOUND
n
-propan-1-ol
ChemIDplus
n-Propanol
KEGG COMPOUND
N-PROPANOL
PDBeChem
n-Propyl alcohol
KEGG COMPOUND
n
-Propylalkohol
ChEBI
Optal
KEGG COMPOUND
Osmosol extra
KEGG COMPOUND
Propan-1-ol
KEGG COMPOUND
Propane-1-ol
KEGG COMPOUND
Propanol
KEGG COMPOUND
propanol-1
ChemIDplus
Propyl alcohol
KEGG COMPOUND
UN 1274
KEGG COMPOUND
Manual Xrefs
Databases
4332
DrugCentral
C05979
KEGG COMPOUND
DB03175
DrugBank
HMDB0000820
HMDB
POL
PDBeChem
Propan-1-ol
Wikipedia
View more database links
Registry Numbers
Types
Sources
1098242
Reaxys Registry Number
Reaxys
25616
Gmelin Registry Number
Gmelin
71-23-8
CAS Registry Number
KEGG COMPOUND
71-23-8
CAS Registry Number
ChemIDplus
71-23-8
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
21741120
PubMed citation
Europe PMC
22565543
PubMed citation
Europe PMC
Last Modified
24 April 2024