(-)-α-Methylbenzyl isocyanate
CAS Registry Number®
14649-03-7
CAS Name
(-)-α-Methylbenzyl isocyanateMolecular Formula
C9H9NOMolecular Mass
147.17Cite this Page
(-)-α-Methylbenzyl isocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=14649-03-7 (retrieved ) (CAS RN: 14649-03-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
42 °C @ Press: 0.1 TorrMelting Point (1)
65 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C9H9NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m0/s1
InChIKey
InChIKey=JJSCUXAFAJEQGB-QMMMGPOBSA-N
SMILES
[C@H](N=C=O)(C)C1=CC=CC=C1
Canonical SMILES
O=C=NC(C=1C=CC=CC1)C
Other Names for this Substance
- Benzene, [(1S)-1-isocyanatoethyl]-
- Isocyanic acid, α-methylbenzyl ester, (-)-
- Benzene, (1-isocyanatoethyl)-, (S)-
- [(1S)-1-Isocyanatoethyl]benzene
- (-)-α-Phenylethyl isocyanate
