| Identification | More | [Name]
(S)-(-)-1-Phenylethyl isocyanate | [CAS]
14649-03-7 | [Synonyms]
ISOCYANIC ACID (S)-(-)-1-PHENYLETHYL ESTER
ISOCYANIC ACID (S)-(-)-ALPHA-METHYLBENZYL ESTER
(S)-(-)-1-PHENYLETHYL ISOCYANATE
(S)-1-PHENYLETHYLISOCYANATE
(S)-(-)-ALPHA-METHYLBENZYL ISOCYANATE
(S)(-)-ALPHA-PHENETHYL ISOCYANATE
(S)-(-)-A-METHYLBENZYL ISOCYANATE
(S) METHYL BENZYLISOCYANATE
IsocyanicAcid(S)-(-)-á-MethylbenzylEster
IsocyanicAcid(S)-(-)-α-MethylbenzylEster
(S)-(-)-ALPHA-METHYLBENZYL ISOCYANATE, 9 9%
Benzene, (1S)-1-isocyanatoethyl-
(s)-(-)-à-methylbenzyl isocyanate
(S)-(-)-1-PHENYLETHYL ISOCYANATE 98+%
(-)-[(S)-1-Isocyanatoethyl]benzene | [EINECS(EC#)]
238-698-6 | [Molecular Formula]
C9H9NO | [MDL Number]
MFCD00002036 | [Molecular Weight]
147.17 | [MOL File]
14649-03-7.mol |
| Chemical Properties | Back Directory | [Appearance]
Colorless to light yellow liqui | [Melting point ]
65 °C | [alpha ]
-10 º (NEAT) | [Boiling point ]
55-56 °C2.5 mm Hg(lit.)
| [density ]
1.045 g/mL at 20 °C(lit.)
| [refractive index ]
n20/D 1.5145(lit.)
| [Fp ]
150 °F
| [storage temp. ]
2-8°C
| [form ]
Liquid | [color ]
Clear colorless to pale yellow | [Optical Rotation]
[α]20/D 10°, neat | [Water Solubility ]
Decomposition | [Sensitive ]
Moisture Sensitive | [BRN ]
4230972 | [InChI]
1S/C9H9NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m0/s1 | [InChIKey]
JJSCUXAFAJEQGB-QMMMGPOBSA-N | [SMILES]
C[C@H](N=C=O)c1ccccc1 | [CAS DataBase Reference]
14649-03-7(CAS DataBase Reference) |
| Safety Data | Back Directory | [Symbol(GHS) ]
 
GHS06,GHS08 | [Signal word ]
Danger | [Hazard statements ]
H315-H317-H319-H330-H334-H335-H412 | [Precautionary statements ]
P260-P273-P280-P302+P352-P304+P340+P310-P305+P351+P338 | [Hazard Codes ]
Xn,T+ | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin .
R42:May cause sensitization by inhalation.
R26:Very Toxic by inhalation. | [Safety Statements ]
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S24/25:Avoid contact with skin and eyes . | [RIDADR ]
UN 2206 6.1/PG 2
| [WGK Germany ]
3
| [F ]
3-10-21 | [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29291090 | [Storage Class]
6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials | [Hazard Classifications]
Acute Tox. 2 Inhalation
Aquatic Chronic 3
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
Colorless to light yellow liqui | [Uses]
(S)-(-)-1-Phenylethyl isocyanate act by inhibition of cell proliferation and induction of apoptosis. It helps to prevent lung cancer and esophageal cancer. It is a fine chemical intermediate. | [General Description]
(S)-(-)-α-Methylbenzyl isocyanate is a commonly used chiral derivatizing agent for the resolution of enantiomers. | [Purification Methods]
Purify the isocyanates by fractional distillation under a vacuum. With ammonia |
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