2-Amino-3-benzyloxy-propionic acid methyl ester supplier

Name
2-Amino-3-benzyloxy-propionic acid methyl ester
EINECS
CAS No. 55895-87-9
Article Data13
CAS DataBase
Density 1.126 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₅NO₃
Boiling Point 330.2 °C at 760 mmHg
Molecular Weight 209.245
Flash Point 146.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl 2-amino-3-(benzyloxy)propanoate;Methyl O-benzylserinate;Serine, O-(phenylmethyl)-, methyl ester;
PSA 61.55000
LogP 1.40380

2-Amino-3-benzyloxy-propionic acid methyl ester Specification

The 2-Amino-3-benzyloxy-propionic acid methyl ester, with the CAS registry number 55895-87-9, is also known as Methyl 2-amino-3-(benzyloxy)propanoate. This chemical's molecular formula is C₁₁H₁₅NO₃ and molecular weight is 209.24. What's more, its systematic name is methyl O-benzylserinate.

Physical properties of 2-Amino-3-benzyloxy-propionic acid methyl ester are: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.35; (4)ACD/LogD (pH 7.4): 1.99; (5)ACD/BCF (pH 5.5): 4.38; (6)ACD/BCF (pH 7.4): 19.1; (7)ACD/KOC (pH 5.5): 65.09; (8)ACD/KOC (pH 7.4): 283.85; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 38.77 Å²; (13)Index of Refraction: 1.522; (14)Molar Refractivity: 56.71 cm³; (15)Molar Volume: 185.6 cm³; (16)Polarizability: 22.48×10^-24cm³; (17)Surface Tension: 42.4 dyne/cm; (18)Density: 1.126 g/cm³; (19)Flash Point: 146.7 °C; (20)Enthalpy of Vaporization: 57.27 kJ/mol; (21)Boiling Point: 330.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000169 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)C(N)COCc1ccccc1
(2)InChI: InChI=1S/C11H15NO3/c1-14-11(13)10(12)8-15-7-9-5-3-2-4-6-9/h2-6,10H,7-8,12H2,1H3
(3)InChIKey: PCLKHOKTUJSLDD-UHFFFAOYSA-N

Product Name

2-Amino-3-benzyloxy-propionic acid methyl ester

2-Amino-3-benzyloxy-propionic acid methyl ester Specification

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