1-Isothiocyanato-4-phenoxybenzene
CAS Registry Number®
3529-87-1
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CAS Name
1-Isothiocyanato-4-phenoxybenzeneMolecular Formula
C13H9NOSMolecular Mass
227.28Cite this Page
1-Isothiocyanato-4-phenoxybenzene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3529-87-1 (retrieved ) (CAS RN: 3529-87-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
143 °C @ Press: 0.2 TorrMelting Point (2)
42 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H9NOS/c16-10-14-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9H
InChIKey
InChIKey=ZKITXAAKDFPASL-UHFFFAOYSA-N
SMILES
O(C1=CC=C(N=C=S)C=C1)C2=CC=CC=C2
Canonical SMILES
S=C=NC1=CC=C(OC=2C=CC=CC2)C=C1
Other Names for this Substance
- Benzene, 1-isothiocyanato-4-phenoxy-
- Isothiocyanic acid, p-phenoxyphenyl ester
- 1-Isothiocyanato-4-phenoxybenzene
- 4-Isothiocyanatodiphenyl ether
- 4-Phenoxyphenyl isothiocyanate
