3-Isothiocyanatobenzonitrile
CAS Registry Number®
3125-78-8
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CAS Name
3-IsothiocyanatobenzonitrileMolecular Formula
C8H4N2SMolecular Mass
160.20Cite this Page
3-Isothiocyanatobenzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3125-78-8 (retrieved ) (CAS RN: 3125-78-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C8H4N2S/c9-5-7-2-1-3-8(4-7)10-6-11/h1-4H
InChIKey
InChIKey=UXCYPHCFQAFVFH-UHFFFAOYSA-N
SMILES
N(=C=S)C1=CC(C#N)=CC=C1
Canonical SMILES
N#CC1=CC=CC(N=C=S)=C1
Other Names for this Substance
- Benzonitrile, 3-isothiocyanato-
- Isothiocyanic acid, m-cyanophenyl ester
- 3-Isothiocyanatobenzonitrile
- m-Cyanophenyl isothiocyanate
- 3-Cyanophenyl isothiocyanate
