L-Phenylalanine benzyl ester hydrochloride supplier

Name
L-Phenylalanine benzyl ester hydrochloride
EINECS 219-558-3
CAS No. 2462-32-0
Article Data12
CAS DataBase
Density
Solubility Soluble in water
Melting Point 197-200 ºC
Formula C₁₆H₁₇NO₂^.HCl
Boiling Point 382.8 °C at 760 mmHg
Molecular Weight 291.777
Flash Point 220.4 °C
Transport Information
Appearance White crystalline powder
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Alanine,phenyl-, benzyl ester, hydrochloride (7CI);Alanine, phenyl-, benzyl ester,hydrochloride, L- (8CI);L-Phenylalanine, phenylmethyl ester, hydrochloride(9CI);Benzyl L-phenylalaninate hydrochloride;Benzyl phenylalaninatehydrochloride;L-Phenylalanine benzyl ester hydrochloride;NSC 522226;Phenylalanine benzyl ester hydrochloride;H-Phe-OBzl.HCl;H-Phe-OBzl·HCl;
PSA 52.32000
LogP 3.80210

L-Phenylalanine benzyl ester hydrochloride Specification

The IUPAC name of L-Phenylalanine,phenylmethyl ester, hydrochloride (1:1) is benzyl 2-amino-3-phenylpropanoate hydrochloride. With the CAS registry number 2462-32-0, it is also named as Benzyl 3-phenyl-L-alaninate hydrochloride. The product's categories are Amino Acid Derivatives; Amino Acids; Phenylalanine [Phe, F]; Amino Acids and Derivatives; Amino Acid Benzyl Esters; Amino Acids (C-Protected); Biochemistry; Amino hydrochloride; Peptide Synthesis; Phenylalanine. It is white crystalline powder which is stable under normal temperature and pressure. In addition, this chemical can be used as biochemical reagent and pharmaceutical intermediate. Besides, it should be sealed in the container and stored in the cool and dry place. And this chemical is dangerous to people, so we should not breathe dust and avoid contact with skin and eyes.

The other characteristics of L-Phenylalanine,phenylmethyl ester, hydrochloride (1:1) can be summarized as: (1)ACD/LogP: 3.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 86; (7)ACD/KOC (pH 5.5): 32; (8)ACD/KOC (pH 7.4): 765; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)Flash Point: 220.4 °C; (12)Enthalpy of Vaporization: 63.12 kJ/mol; (13)Boiling Point: 382.8 °C at 760 mmHg; (14)Vapour Pressure: 4.62E-06 mmHg at 25°C; (15)Rotatable Bond Count: 6; (16)Exact Mass: 291.102607; (17)MonoIsotopic Mass: 291.102607; (18)Topological Polar Surface Area: 52.3; (19)Heavy Atom Count: 20; (20)Complexity: 268.

People can use the following data to convert to the molecule structure.
1. SMILES:[Cl-].O=C(OCc1ccccc1)[C@@H]([NH3+])Cc2ccccc2
2. InChI=1/C16H17NO2.ClH/c17-15(11-13-7-3-1-4-8-13)16(18)19-12-14-9-5-2-6-10-14;/h1-10,15H,11-12,17H2;1H/t15-;/m0./s1

Product Name

L-Phenylalanine benzyl ester hydrochloride

L-Phenylalanine benzyl ester hydrochloride Specification

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