1-Bromo-4-tert-butylbenzene
CAS Registry Number®
3972-65-4
CAS Name
1-Bromo-4-tert-butylbenzeneMolecular Formula
C10H13BrMolecular Mass
213.11Cite this Page
1-Bromo-4-tert-butylbenzene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3972-65-4 (retrieved ) (CAS RN: 3972-65-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
231.5 °CMelting Point (1)
19 °CDensity (2)
1.2028 g/cm³ @ Temp: 30 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Legge, D. I.; Journal of the American Chemical Society, (1947), 69, 2086-90, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H13Br/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3
InChIKey
InChIKey=XHCAGOVGSDHHNP-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=CC=C(Br)C=C1
Canonical SMILES
BrC1=CC=C(C=C1)C(C)(C)C
Other Names for this Substance
- Benzene, 1-bromo-4-(1,1-dimethylethyl)-
- Benzene, 1-bromo-4-tert-butyl-
- 1-Bromo-4-(1,1-dimethylethyl)benzene
- p-tert-Butylbromobenzene
- 1-Bromo-4-tert-butylbenzene
