4-Chloro-1-isothiocyanato-2-methylbenzene
CAS Registry Number®
23165-53-9
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CAS Name
4-Chloro-1-isothiocyanato-2-methylbenzeneMolecular Formula
C8H6ClNSMolecular Mass
183.66Cite this Page
4-Chloro-1-isothiocyanato-2-methylbenzene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=23165-53-9 (retrieved ) (CAS RN: 23165-53-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
136 °C @ Press: 13 TorrMelting Point (2)
37-38 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C8H6ClNS/c1-6-4-7(9)2-3-8(6)10-5-11/h2-4H,1H3
InChIKey
InChIKey=XTYLRVPBHHRTMS-UHFFFAOYSA-N
SMILES
N(=C=S)C1=C(C)C=C(Cl)C=C1
Canonical SMILES
S=C=NC1=CC=C(Cl)C=C1C
Other Names for this Substance
- Benzene, 4-chloro-1-isothiocyanato-2-methyl-
- Isothiocyanic acid, 4-chloro-o-tolyl ester
- 4-Chloro-1-isothiocyanato-2-methylbenzene
- 4-Chloro-2-methylphenyl isothiocyanate
- 4-Chloro-o-tolyl isothiocyanate
