1-Chloro-4-(1,1-dimethylethyl)benzene
CAS Registry Number®
3972-56-3
CAS Name
1-Chloro-4-(1,1-dimethylethyl)benzeneMolecular Formula
C10H13ClMolecular Mass
168.66Cite this Page
1-Chloro-4-(1,1-dimethylethyl)benzene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3972-56-3 (retrieved ) (CAS RN: 3972-56-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
213 °CMelting Point (2)
23 °CDensity (3)
1.0075 g/cm³ @ Temp: 18.5 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Ruechardt, Christoph; Chem. Bet., (1961), 94, 2609-23, CAplus
- (3) Boedtker, Eyvind; Bulletin de la Societe Chimique de France, (1907), 35, 825-36, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H13Cl/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3
InChIKey
InChIKey=XRTANKYQJQXSFP-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=CC=C(Cl)C=C1
Canonical SMILES
ClC1=CC=C(C=C1)C(C)(C)C
Other Names for this Substance
- Benzene, 1-chloro-4-(1,1-dimethylethyl)-
- Benzene, 1-tert-butyl-4-chloro-
- 1-Chloro-4-(1,1-dimethylethyl)benzene
- p-Chloro-tert-butylbenzene
- 1-tert-Butyl-4-chlorobenzene