Phenethyl isocyanate
CAS Registry Number®
1943-82-4
CAS Name
Phenethyl isocyanateMolecular Formula
C9H9NOMolecular Mass
147.17Cite this Page
Phenethyl isocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1943-82-4 (retrieved ) (CAS RN: 1943-82-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
109-111 °C @ Press: 13 TorrDensity (2)
1.0618 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Forster, M. O.; Journal of the Chemical Society, Transactions, (1911), 99, 1337-40, CAplus
- (2) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2
InChIKey
InChIKey=HACRKYQRZABURO-UHFFFAOYSA-N
SMILES
C(CN=C=O)C1=CC=CC=C1
Canonical SMILES
O=C=NCCC=1C=CC=CC1
Other Names for this Substance
- Benzene, (2-isocyanatoethyl)-
- Isocyanic acid, phenethyl ester
- Phenethyl alcohol, isocyanate
- (2-Isocyanatoethyl)benzene
- Phenethyl isocyanate
Deleted or Replaced CAS Registry Numbers
1025436-20-7
