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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:47105 - 1-bromopropane
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ChEBI Name
1-bromopropane
ChEBI ID
CHEBI:47105
Definition
A bromoalkane that is propane carrying a bromo substituent at position 1.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C3H7Br
Net Charge
0
Average Mass
122.99200
Monoisotopic Mass
121.97311
InChI
InChI=1S/C3H7Br/c1-2-3-4/h2-3H2,1H3
InChIKey
CYNYIHKIEHGYOZ-UHFFFAOYSA-N
SMILES
CCCBr
Roles Classification
Chemical Role
(s):
solvent
A liquid that can dissolve other substances (solutes) without any change in their chemical composition.
Biological Role
(s):
neurotoxin
A poison that interferes with the functions of the nervous system.
Application
(s):
solvent
A liquid that can dissolve other substances (solutes) without any change in their chemical composition.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-bromopropane (
CHEBI:47105
)
has role
neurotoxin (
CHEBI:50910
)
1-bromopropane (
CHEBI:47105
)
has role
solvent (
CHEBI:46787
)
1-bromopropane (
CHEBI:47105
)
is a
bromoalkane (
CHEBI:22929
)
1-bromopropane (
CHEBI:47105
)
is a
bromohydrocarbon (
CHEBI:22926
)
IUPAC Name
1-bromopropane
Synonyms
Sources
1-bromopropane
UniProt
n
-propyl bromide
ChEBI
Manual Xrefs
Databases
3BR
PDBeChem
N-Propyl_bromide
Wikipedia
View more database links
Registry Numbers
Types
Sources
106-94-5
CAS Registry Number
ChemIDplus
505936
Reaxys Registry Number
Reaxys
Citations
Types
Sources
21830855
PubMed citation
Europe PMC
22893012
PubMed citation
Europe PMC
23183024
PubMed citation
Europe PMC
23266320
PubMed citation
Europe PMC
24438363
PubMed citation
Europe PMC
Last Modified
20 May 2021