(4-Nitrophenyl)methyl thiocyanate
CAS Registry Number®
13287-49-5
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CAS Name
(4-Nitrophenyl)methyl thiocyanateMolecular Formula
C8H6N2O2SMolecular Mass
194.21Cite this Page
(4-Nitrophenyl)methyl thiocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13287-49-5 (retrieved ) (CAS RN: 13287-49-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
85-86 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C8H6N2O2S/c9-6-13-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5H2
InChIKey
InChIKey=NUMYTLIHYKESKM-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=CC=C(CSC#N)C=C1
Canonical SMILES
N#CSCC1=CC=C(C=C1)N(=O)=O
Other Names for this Substance
- Thiocyanic acid, (4-nitrophenyl)methyl ester
- Thiocyanic acid, p-nitrobenzyl ester
- Toluene, p-nitro-α-thiocyanato-
- (4-Nitrophenyl)methyl thiocyanate
- 4-Nitrobenzyl thiocyanate
