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Substance Name: Methyl 4-bromobutyrate
RN: 4897-84-1
InChIKey: QAWFLJGZSZIZHO-UHFFFAOYSA-N

Molecular Formula

  • C5-H9-Br-O2

Molecular Weight

  • 181.028
 
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Names and Synonyms

Synonym

  • EINECS 225-523-3

Systematic Name

  • Methyl 4-bromobutyrate

Registry Numbers

CAS Registry Number

  • 4897-84-1

System Generated Number

  • 0004897841

Structure Descriptors

InChI

1S/C5H9BrO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3

InChIKey

QAWFLJGZSZIZHO-UHFFFAOYSA-N

Smiles

BrCCCC(=O)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 186.5 deg C   EXP
log P (octanol-water) 1.700 (none)   EST
Atmospheric OH Rate Constant 1.42E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.