3-Methylphenyl-L-alanine supplier

Name
3-Methylphenyl-L-alanine
EINECS 145-896-5
CAS No. 114926-37-3
Density 1.165 g/cm³
Solubility Slightly soluble in water.
Melting Point
Formula C₁₀H₁₃NO₂
Boiling Point 322.8 °C at 760 mmHg
Molecular Weight 179.22
Flash Point 149 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms L-3-Methylphenylalanine;(2S)-2-Amino-3-(3-methylphenyl)propanoic acid;3-Methyl-L-phenylalanin;3-Methyl-L-phenylalanine;
PSA 63.32000
LogP 1.64970

3-Methylphenyl-L-alanine Specification

The L-Phenylalanine,3-methyl-, with the CAS registry number 114926-37-3, has the systematic name of 3-methyl-L-phenylalanine. It is also called (2S)-2-Amino-3-(3-methylphenyl)propanoic acid. And the molecular formula of this chemical is C₁₀H₁₃NO₂. It belongs to the following product categories: Amino Acids; Phenylalanine analogs and other aromatic alpha amino acids; Amino Acid Derivatives; α-amino. What's more, it should be stored at -15°C.

The physical properties of L-Phenylalanine,3-methyl- are as following: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.93; (4)ACD/LogD (pH 7.4): -0.93; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1 ; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.568; (14)Molar Refractivity: 50.31 cm³; (15)Molar Volume: 153.7 cm³; (16)Polarizability: 19.94×10^-24cm³; (17)Surface Tension: 50.3 dyne/cm; (18)Density: 1.165 g/cm³; (19)Flash Point: 149 °C; (20)Enthalpy of Vaporization: 59.62 kJ/mol; (21)Boiling Point: 322.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000112 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)Cc1cccc(c1)C
(2)InChI: InChI=1/C10H13NO2/c1-7-3-2-4-8(5-7)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1
(3)InChIKey: JZRBSTONIYRNRI-VIFPVBQEBI

Product Name

3-Methylphenyl-L-alanine

3-Methylphenyl-L-alanine Specification

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