CAS Registry Number®
98-51-1
CAS Name
4-tert-Butyltoluene
Molecular Formula
C11H16
Molecular Mass
148.24
Compound Properties
-
Boiling Point (1)
193 °C @ Press: 760 Torr
-
Melting Point (1)
-52 °C
-
Density (1)
0.8612 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C11H16/c1-9-5-7-10(8-6-9)11(2,3)4/h5-8H,1-4H3
InChIKey
InChIKey=QCWXDVFBZVHKLV-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=CC=C(C)C=C1
Canonical SMILES
C=1C=C(C=CC1C)C(C)(C)C
Other Names for this Substance
- Benzene, 1-(1,1-dimethylethyl)-4-methyl-
- Toluene, p–tert-butyl-
- 1-(1,1-Dimethylethyl)-4-methylbenzene
- p–tert-Butyltoluene
- 1-tert-Butyl-4-methylbenzene
- 4-Methyl-tert-butylbenzene
- 1-Methyl-4-tert-butylbenzene
- 4-tert-Butyltoluene
- 4-tert-Butyl-1-methylbenzene
- p-Methyl-tert-butylbenzene
- NSC 6589
- 1-Methyl-4-(1,1-dimethylethyl)benzene
