(S)-(-)-ALPHA-METHYLBENZYL ISOCYANATE

CAS No.
14649-03-7
CCD No.
CCD00001960
Formula
C9H9NO
MolWeight
147.176

Basic Information

Product Name: (S)-(-)-ALPHA-METHYLBENZYL ISOCYANATE
CAS: 14649-03-7
English Synonyms: EMOLECULES 489387 ; ISOCYANIC ACID (S)-(-)-A-METHYLBENZYL ESTER ; (S)-(-)-ALPHA-METHYLBENZYL ISOCYANATE ; [(1S)-1-ISOCYANATOETHYL]BENZENE ; (S) A-METHYL BENZYLISOCYANATE ; (S)-1-PHENYLETHYLISOCYANATE ; ISOCYANIC ACID (S)-(-)-BETA-METHYLBENZYL ESTER ; (S)-(-)-1-PHENYLETHYL ISOCYANATE ; ISOCYANIC ACID (S)-(-)-METHYLBENZYL ESTER ; ISOCYANIC ACID (S)-(-)-ALPHA-METHYLBENZYL ESTER ; ISOCYANIC ACID (S)-(-)-1-METHYLBENZYL ESTER
MDL Number.: MFCD00002036
H bond acceptor: 2
H bond donor: 0
Smile: C[C@@H](C1=CC=CC=C1)N=C=O
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

Property

Boiling Point: 55-56 DEG C/2.5 MMHG(LIT)
Density: 1.045g/mLat20°C(lit.)
Physical Property: FLASHPOINT: 149 DEG F
FLASHPOINT: 65 DEG C
REFRACTIVE INDEX: N20/D 1.5145(LIT)
Comments: ASSAY METHOD: GC
LEGAL INFORMATION: CHIPROS IS A REGISTERED TRADEMARK OF BASF SE
WGK: 3
Specification: PRODUCED BY BASF
Information: OPTICAL PURITY: ENANTIOMERIC EXCESS: =>98.5%

Safety information

Symbol: GHS06 GHS06 GHS08 GHS08
Signal word: Danger
Hazard statements: H315-H319-H330-H334-H335
Precautionary statements: P260-P284-P305 + P351 + P338-P310
hazard symbol: T
Risk Code: R:23-36/37/38-42
Safe Code: S:23-26-45
WGK Germany: 3

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