(4-Chlorophenyl)methyl thiocyanate
CAS Registry Number®
2082-64-6
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CAS Name
(4-Chlorophenyl)methyl thiocyanateMolecular Formula
C8H6ClNSMolecular Mass
183.66Cite this Page
(4-Chlorophenyl)methyl thiocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=2082-64-6 (retrieved ) (CAS RN: 2082-64-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
176-179 °C @ Press: 10 TorrMelting Point (2)
40-41 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Yadav, Lal Dhar S.; Synthetic Communications, (2011), 41(1), 100-112, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H6ClNS/c9-8-3-1-7(2-4-8)5-11-6-10/h1-4H,5H2
InChIKey
InChIKey=LCVXZQSGKZLSOR-UHFFFAOYSA-N
SMILES
C(SC#N)C1=CC=C(Cl)C=C1
Canonical SMILES
N#CSCC1=CC=C(Cl)C=C1
Other Names for this Substance
- Thiocyanic acid, (4-chlorophenyl)methyl ester
- Thiocyanic acid, p-chlorobenzyl ester
- (4-Chlorophenyl)methyl thiocyanate
- p-Chlorobenzyl thiocyanate
- NSC 56501
