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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:144331 - 1-bromo-2-propanol
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ChEBI Ontology
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ChEBI Name
1-bromo-2-propanol
ChEBI ID
CHEBI:144331
Definition
A secondary alcohol that is propan-2-ol substituted by a bromo group at position 1.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Mark Williams
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Formula
C3H7BrO
Net Charge
0
Average Mass
138.992
Monoisotopic Mass
137.96803
InChI
InChI=1S/C3H7BrO/c1-3(5)2-4/h3,5H,2H2,1H3
InChIKey
WEGOLYBUWCMMMY-UHFFFAOYSA-N
SMILES
BrCC(C)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in umbilical vein endothelial cell line
(BTO:0001520)
. See:
MetaboLights Study
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-bromo-2-propanol (
CHEBI:144331
)
has role
human metabolite (
CHEBI:77746
)
1-bromo-2-propanol (
CHEBI:144331
)
is a
organobromine compound (
CHEBI:37141
)
1-bromo-2-propanol (
CHEBI:144331
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
1-bromopropan-2-ol
Synonyms
Sources
1-bromo-2-hydroxypropane
NIST Chemistry WebBook
2-hydroxy-2-methylethyl bromide
NIST Chemistry WebBook
2-hydroxybromopropane
ChEBI
2-hydroxypropyl bromide
ChemIDplus
2-propanol, 1-bromo-
ChEBI
propylene bromohydrin
NIST Chemistry WebBook
Registry Numbers
Types
Sources
1071195
Beilstein Registry Number
Beilstein
19686-73-8
CAS Registry Number
NIST Chemistry WebBook
19686-73-8
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10379989
PubMed citation
Europe PMC
16513153
PubMed citation
Europe PMC
17093198
PubMed citation
Europe PMC
18555422
PubMed citation
Europe PMC
24152118
PubMed citation
Europe PMC
26525262
PubMed citation
Europe PMC
31067084
PubMed citation
Europe PMC
Last Modified
04 February 2020