4-Chlorophenyl isocyanate
CAS Registry Number®
104-12-1
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CAS Name
4-Chlorophenyl isocyanateMolecular Formula
C7H4ClNOMolecular Mass
153.57Cite this Page
4-Chlorophenyl isocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=104-12-1 (retrieved ) (CAS RN: 104-12-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
115-117 °C @ Press: 45 TorrMelting Point (1)
30-31 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C7H4ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey
InChIKey=ADAKRBAJFHTIEW-UHFFFAOYSA-N
SMILES
N(=C=O)C1=CC=C(Cl)C=C1
Canonical SMILES
O=C=NC1=CC=C(Cl)C=C1
Other Names for this Substance
- Benzene, 1-chloro-4-isocyanato-
- Isocyanic acid, p-chlorophenyl ester
- 1-Chloro-4-isocyanatobenzene
- p-Chlorophenyl isocyanate
- 4-Chlorophenyl isocyanate
