Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1) supplier

Name
ALPHA-METHYL-DL-PHENYLALANINE METHYL ESTER HYDROCHLORIDE
EINECS
CAS No. 64665-60-7
Article Data2
CAS DataBase
Density
Solubility
Melting Point 138-143 °C
Formula C₁₁H₁₆ClNO₂
Boiling Point 310.4 °C at 760 mmHg
Molecular Weight 229.707
Flash Point 141.5 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms DL-Phenylalanine,a-methyl-, methyl ester,hydrochloride;Phenylalanine, a-methyl-, methyl ester, hydrochloride (9CI);
PSA 52.32000
LogP 2.62180

Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1) Specification

The Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1), with the CAS registry number 64665-60-7, is also known asα-Methyl-DL-phenylalanine methyl ester hydrochloride. This chemical's molecular formula is C₁₁H₁₆ClNO₂ and molecular weight is 229.7. What's more, its systematic name is Methyl α-methylphenylalaninate hydrochloride. In addition, the dust of this chemical can not be breathed. During using it, you should avoid contacting with skin and eyes. Besides, it should be stored at -20 °C.

Physical properties about Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1) are: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 52.32 Å²; (7)Flash Point: 141.5 °C; (8)Enthalpy of Vaporization: 56.22 kJ/mol; (9)Boiling Point: 310.4 °C at 760 mmHg; (10)Vapour Pressure: 0.000445 mmHg at 25 °C.

Uses of Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1): it is used to produce other chemicals at ambient temperature. For example, it is used to produce Boc-Pro-(SR)-α-MePhe-OMe. This reaction needs reagents DIEA, HOBt, EDC•HCl. Meanwhile, it needs solvent Dimethylformamide. The yield is about 54 %.

Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1) can react with 1-tert-Butoxycarbonyl-L-proline to get Boc-Pro-(SR)-a-MePhe-Ome.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.NC(C)(Cc1ccccc1)C(=O)OC
(2) InChI: InChI=1/C11H15NO2.ClH/c1-11(12,10(13)14-2)8-9-6-4-3-5-7-9;/h3-7H,8,12H2,1-2H3;1H
(3) InChIKey: VUYGLGCVKCLWPY-UHFFFAOYAI

Product Name

ALPHA-METHYL-DL-PHENYLALANINE METHYL ESTER HYDROCHLORIDE

Phenylalanine, α-methyl-, methyl ester,hydrochloride (1:1) Specification

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