Octanoic acid, 2-bromo-, methyl ester
CAS Registry Number®
5445-22-7
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CAS Name
Octanoic acid, 2-bromo-, methyl esterMolecular Formula
C9H17BrO2Molecular Mass
237.13Cite this Page
Octanoic acid, 2-bromo-, methyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5445-22-7 (retrieved ) (CAS RN: 5445-22-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
15 °C @ Press: 0.6 Torr
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C9H17BrO2/c1-3-4-5-6-7-8(10)9(11)12-2/h8H,3-7H2,1-2H3
InChIKey
InChIKey=RCMQQTUVWBXJQS-UHFFFAOYSA-N
SMILES
C(CCCCCC)(C(OC)=O)Br
Canonical SMILES
O=C(OC)C(Br)CCCCCC
Other Names for this Substance
- Octanoic acid, 2-bromo-, methyl ester
- Methyl 2-bromooctanoate
- NSC 21981
Deleted or Replaced CAS Registry Numbers
135339-61-6
