ChemicalBook--->CAS DataBase List--->131690-61-4

131690-61-4

131690-61-4 Structure

131690-61-4 Structure
IdentificationMore
[Name]

(R)-3-AMINO-3-(4-CHLORO-PHENYL)-PROPIONIC ACID
[CAS]

131690-61-4
[Synonyms]

H-D-BETA-PHE(4-CL)-OH
H-PHG(4-CL)-(C*CH2)OH
L-BETA-HOMO(4-CHLOROPHENYL)GLYCINE
(R)-3-AMINO-3-(4-CHLORO-PHENYL)-PROPIONIC ACID
(R)-4-CHLORO-BETA-PHENYLALANINE
(R)-BETA-(P-CHLOROPHENYL)ALANINE
(R)-B-(P-CHLOROPHENYL)-B-ALANINE
(R)-beta-4-Chlorophenylalanine
(R)--(p-Chlorophenyl)alanine
(R)-3-(P-CHLOROPHENYL)-BETA-ALANINE
H-D-b-Phe(4-Cl)-OH
[Molecular Formula]

C9H10ClNO2
[MDL Number]

MFCD03840387
[Molecular Weight]

199.63
[MOL File]

131690-61-4.mol
Chemical PropertiesBack Directory
[Melting point ]

241-244 °C (sublm)(Solv: water (7732-18-5); acetone (67-64-1))
[Boiling point ]

345.8±32.0 °C(Predicted)
[density ]

1.333±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[pka]

3.62±0.10(Predicted)
[InChI]

InChI=1/C9H10ClNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/s3
[InChIKey]

BXGDBHAMTMMNTO-SBYBRXNCNA-N
[SMILES]

C1(C=CC(Cl)=CC=1)[C@H](N)CC(=O)O |&1:7,r|
[CAS DataBase Reference]

131690-61-4(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H335-H315
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[HS Code ]

2922498590
Hazard InformationBack Directory
[Uses]

(R)-3-Amino-3-(4-chloro-phenyl)-propionic Acid is used in the synthesis of N-Benzoyl Phenylisoserinoyl side-chain of the anticancer drug taxol.
Spectrum DetailBack Directory
[Spectrum Detail]

(R)-3-AMINO-3-(4-CHLORO-PHENYL)-PROPIONIC ACID(131690-61-4)1HNMR
(R)-3-AMINO-3-(4-CHLORO-PHENYL)-PROPIONIC ACID(131690-61-4)1HNMR
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