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(R)-alpha-Methyltyrosine (672-86-6)

Identification
Name:(R)-alpha-Methyltyrosine
Synonyms:(R)-alpha-Methyl-4-hydroxyphenylalanine, (R)-a-Methyltyrosine (>98%, >98%ee);alpha-methyl-D-tyrosine;
CAS:672-86-6
Molecular Formula: C10H13NO3
Molecular Weight: 195.21
Molecular Structure: (C10H13NO3) (R)-alpha-Methyl-4-hydroxyphenylalanine, (R)-a-Methyltyrosine ( 98%, 98%ee);alpha-methyl-D-tyrosine;
Properties
Density:1.283 g/cm3
Specification:

The CAS register number of (R)-alpha-Methyltyrosine is 672-86-6. It also can be called as alpha-methyl-D-tyrosine and the systematic name about this chemical is α-methyl-D-tyrosine. The molecular formula about this chemical is C10H13NO3 and molecular weight is 195.21.

Physical properties about (R)-alpha-Methyltyrosine are: (1)ACD/LogP: 0.73; (2)ACD/LogD (pH 5.5): -1.77; (3)ACD/LogD (pH 7.4): -1.78; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 38.77Å2; (12)Index of Refraction: 1.599; (13)Molar Refractivity: 52.01 cm3; (14)Molar Volume: 152 cm3; (15)Polarizability: 20.62x10-24cm3; (16)Surface Tension: 60.6 dyne/cm; (17)Enthalpy of Vaporization: 66.7 kJ/mol; (18)Boiling Point: 383.7 °C at 760 mmHg; (19)Vapour Pressure: 1.42E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@](N)(Cc1ccc(O)cc1)C
(2)InChI: InChI=1/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m1/s1
(3)InChIKey: NHTGHBARYWONDQ-SNVBAGLBBN
(4)Std. InChI: InChI=1S/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m1/s1
(5)Std. InChIKey: NHTGHBARYWONDQ-SNVBAGLBSA-N

Safety Data