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CHEBI:747005 - 1-chlorobutane

Default Structure
ChEBI IDCHEBI:747005
ChEBI Name1-chlorobutane
Stars
Last Modified4 December 2025
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC4H9Cl
Net Charge0
Average Mass92.569
Monoisotopic Mass92.03928
SMILESCCCCCl
InChIInChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3
InChIKeyVFWCMGCRMGJXDK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-chlorobutane (CHEBI:747005) is a 1-haloalkane (CHEBI:18060)
1-chlorobutane (CHEBI:747005) is a chloroalkane (CHEBI:23128)
1-chlorobutane (CHEBI:747005) is a organic molecular entity (CHEBI:50860)
1-chlorobutane (CHEBI:747005) is a organochlorine compound (CHEBI:36683)
Synonyms  Source
butyl chlorideChEMBL
Butyl chlorideChEMBL
N-butyl chlorideChEMBL
NSC-8419ChEMBL
UniProt Name  Source
1-chlorobutaneUniProt
Citations