(S)-(-)-1-Phenylethyl isocyanate

Base Information Edit

Chemical Name:(S)-(-)-1-Phenylethyl isocyanate
CAS No.:14649-03-7
Molecular Formula:C9H9NO
Molecular Weight:147.177
Hs Code.:29291090
European Community (EC) Number:238-698-6
Nikkaji Number:J63.266J
Mol file:14649-03-7.mol

Synonyms:Benzene,(1-isocyanatoethyl)-, (S)-;Isocyanic acid, a-methylbenzyl ester, (-)- (8CI);((1S)-1-Isocyanatoethyl)benzene;(-)-(S)-a-Methylbenzyl isocyanate;(-)-(S)-a-Phenethyl isocyanate;(-)-(S)-a-Phenylethyl isocyanate;(-)-1-Phenethyl isocyanate;(-)-1-Phenylethyl isocyanate;(-)-a-Methylbenzyl isocyanate;(-)-a-Phenylethyl isocyanate;(S)-(-)-a-Methylbenzyl isocyanate;(S)-1-Phenethyl isocyanate;(S)-1-Phenyl-1-isocyanatoethane;(S)-1-Phenylethylisocyanate;(S)-a-Methylbenzylisocyanate;S-(-)-a-Phenylethyl isocyanate;[(S)-1-Isocyanatoethyl]benzene;

Suppliers and Price of (S)-(-)-1-Phenylethyl isocyanate

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
(S)-(-)-1-Phenylethylisocyanate
100mg
$ 75.00

TCI Chemical
(S)-(-)-alpha-Methylbenzyl Isocyanate >98.0%(GC)
1g
$ 44.00

TCI Chemical
(S)-(-)-alpha-Methylbenzyl Isocyanate >98.0%(GC)
5g
$ 120.00

SynQuest Laboratories
(S)-(-)-alpha-Methylbenzyl isocyanate
1 g
$ 60.00

SynQuest Laboratories
(S)-(-)-alpha-Methylbenzyl isocyanate
5 g
$ 195.00

Sigma-Aldrich
(S)-(?)-α-Methylbenzyl isocyanate for chiral derivatization, ≥99.0%
5ml
$ 516.00

Sigma-Aldrich
(S)-(?)-α-Methylbenzyl isocyanate 98%
5g
$ 160.00

Sigma-Aldrich
(S)-(?)-α-Methylbenzyl isocyanate 98%
1g
$ 45.70

Sigma-Aldrich
(S)-(?)-α-Methylbenzyl isocyanate for chiral derivatization, ≥99.0%
1ml
$ 132.00

Oakwood
(S)-(?)-α-Methylbenzyl isocyanate 98%
1g
$ 25.00

Total 50 raw suppliers

Chemical Property of (S)-(-)-1-Phenylethyl isocyanate Edit

Chemical Property:

Appearance/Colour:Colorless to light yellow liquid
Vapor Pressure:0.268mmHg at 25°C
Melting Point:65 °C
Refractive Index:n20/D 1.5145(lit.)
Boiling Point:204.089 °C at 760 mmHg
Flash Point:65.556 °C
PSA：29.43000
Density:0.982 g/cm³
LogP:2.08340
Storage Temp.:2-8°C
Sensitive.:Moisture Sensitive
Water Solubility.:Decomposition
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:147.068413911
Heavy Atom Count:11
Complexity:155

Purity/Quality:

98% ^*data from raw suppliers

(S)-(-)-1-Phenylethylisocyanate ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn; T+
Hazard Codes:Xn,T+,T
Statements: 36/37/38-42-26-23
Safety Statements: 23-26-36-45-24/25

MSDS Files:: Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C1=CC=CC=C1)N=C=O
Isomeric SMILES:C[C@@H](C1=CC=CC=C1)N=C=O
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.

Technology Process of (S)-(-)-1-Phenylethyl isocyanate

There total 32 articles about (S)-(-)-1-Phenylethyl isocyanate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%