Methyl 4-tert-butylbenzoate
CAS Registry Number®
26537-19-9
CAS Name
Methyl 4-tert-butylbenzoateMolecular Formula
C12H16O2Molecular Mass
192.25Cite this Page
Methyl 4-tert-butylbenzoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=26537-19-9 (retrieved ) (CAS RN: 26537-19-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
110-112 °C @ Press: 5 TorrDensity (2)
1.0113 g/cm³ @ Temp: 20.000 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Aniya, Vineet; Journal of Chemical & Engineering Data, (2017), 62(1), 96-104, CAplus
Other Names and Identifiers
InChI
InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey
InChIKey=UPIJOAFHOIWPLT-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=CC=C(C(OC)=O)C=C1
Canonical SMILES
O=C(OC)C1=CC=C(C=C1)C(C)(C)C
Other Names for this Substance
- Benzoic acid, 4-(1,1-dimethylethyl)-, methyl ester
- Benzoic acid, p-tert-butyl-, methyl ester
- Methyl p-tert-butylbenzoate
- Methyl 4-tert-butylbenzoate
- Methyl 4-(1,1-dimethylethyl)benzoate
