sec-Butyl benzoate
CAS Registry Number®
3306-36-3
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CAS Name
sec-Butyl benzoateMolecular Formula
C11H14O2Molecular Mass
178.23Cite this Page
sec-Butyl benzoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3306-36-3 (retrieved ) (CAS RN: 3306-36-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
98-99 °C @ Press: 13 TorrDensity (1)
1.002 g/cm³ @ Temp: 17 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C11H14O2/c1-3-9(2)13-11(12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey
InChIKey=LSLWNAOQPPLHSW-UHFFFAOYSA-N
SMILES
C(OC(CC)C)(=O)C1=CC=CC=C1
Canonical SMILES
O=C(OC(C)CC)C=1C=CC=CC1
Other Names for this Substance
- Benzoic acid, 1-methylpropyl ester
- Benzoic acid, sec-butyl ester
- 1-Methylpropyl benzoate
- sec-Butyl benzoate
- 2-Butyl benzoate
Deleted or Replaced CAS Registry Numbers
5556-97-8
