(S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester

Base Information Edit

Chemical Name:(S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester
CAS No.:40203-94-9
Molecular Formula:C11H11NO3
Molecular Weight:205.213
Hs Code.:29291090
European Community (EC) Number:625-532-6
DSSTox Substance ID:DTXSID70960627
Nikkaji Number:J510.749K
Mol file:40203-94-9.mol

Synonyms:40203-94-9;(S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester;methyl (2S)-2-isocyanato-3-phenylpropanoate;Methyl (S)-(-)-2-isocyanato-3-phenylpropionate;n-carbonyl-l-phenylalanine methyl ester;(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER;(S)-methyl 2-isocyanato-3-phenylpropanoate;Methyl (S)-2-Isocyanato-3-phenylpropionate;methyl N-(oxomethylidene)phenylalaninate;SCHEMBL135996;DTXSID70960627;carbonyl-l-phenylalanine methyl ester;MFCD00191535;AKOS015855486;AKOS015910059;methyl (S)-2-isocyanato-3-phenylpropanoate;(S)-methyl-2-isocyanato-3-phenyl-propionate;I0472;D91160;methyl(S)-(-)-2-isocyanato-3-phenylpropionate;(S )-2-Isocyanato-3-phenylpropionic acid methyl ester;(S)-2-isocyanato-3-phenyl-propionic acid methyl ester;(S)-2-isocyanato-3-phenylpropanoic acid methyl ester;Methyl (S)-(-)-2-isocyanato-3-phenylpropionate, 99%

Suppliers and Price of (S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester

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
Methyl(2S)-2-Isocyanato-3-phenylpropanoate
100mg
$ 60.00

TCI Chemical
Methyl (S)-2-Isocyanato-3-phenylpropionate >97.0%(GC)
5g
$ 182.00

Sigma-Aldrich
Methyl (S)-(?)-2-isocyanato-3-phenylpropionate 99%
5g
$ 187.00

Matrix Scientific
Methyl N-(oxomethylene)phenylalaninate
500mg
$ 189.00

American Custom Chemicals Corporation
(S)-2-ISOCYANATO-3-PHENYLPROPIONIC ACID METHYL ESTER 95.00%
500MG
$ 785.40

AK Scientific
MethylN-(oxomethylene)phenylalaninate
5g
$ 325.00

AHH
(S)-2-Isocyanato-3-phenylpropionicacidmethylester 98%
25g
$ 345.00

Total 15 raw suppliers

Chemical Property of (S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester Edit

Chemical Property:

Vapor Pressure:0.00178mmHg at 25°C
Melting Point:23 °C
Refractive Index:n20/D 1.513(lit.)
Boiling Point:292.9 °C at 760 mmHg
Flash Point:127.1 °C
PSA：55.73000
Density:1.1 g/cm³
LogP:1.10650
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:205.07389321
Heavy Atom Count:15
Complexity:253

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl(2S)-2-Isocyanato-3-phenylpropanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 20/21/22-36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C(CC1=CC=CC=C1)N=C=O
Isomeric SMILES:COC(=O)[C@H](CC1=CC=CC=C1)N=C=O
Uses This compound has been employed in the preparation of dipeptide analogs of angiotensinogen and Schiff base derivatives for the inhibition of thermolysin.

Technology Process of (S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester

There total 13 articles about (S)-2-Isocyanato-3-phenylpropionic Acid Methyl Ester 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: 98.0%

: 7524-50-7
methyl (2S)-2-amino-3-phenylpropanoate hydrochloride

: 40203-94-9
methyl (S)-2-isocyanato-3-phenylpropanoate

Guidance literature:: With bis(trichloromethyl) carbonate; sodium hydrogencarbonate; In dichloromethane; Cooling with ice;
DOI:10.15227/orgsyn.078.0220