Boc-O-methyl-L-tyrosine supplier

Name
Boc-O-methyl-L-tyrosine
EINECS
CAS No. 53267-93-9
Article Data21
CAS DataBase
Density 1.168 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₁NO₅
Boiling Point 462 °C at 760 mmHg
Molecular Weight 295.335
Flash Point 233.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2S)-2-[(tert-Butoxycarbonyl)amino]-3-(4-methoxyphenyl)propionicacid;(S)-2-[(tert-Butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid;(S)-2-[(tert-Butoxycarbonyl)amino]-3-(4-methoxyphenyl)propionic acid;N-tert-Butoxycarbonyl-O-methyl-L-tyrosine;tert-Butoxycarbonyl-L-4-methoxyphenylalanine;
PSA 84.86000
LogP 2.60650

Boc-O-methyl-L-tyrosine Specification

The Boc-O-methyl-L-tyrosine, with the CAS registry number 53267-93-9, has the systematic name of N-(tert-butoxycarbonyl)-O-methyl-L-tyrosine. It should be stored at 0-5°C, and belongs to the product categories: Phenylalanine [Phe, F]; Unusual Amino Acids; Boc-Amino Acids and Derivative; Boc-Amino acid series. The molecular formula of the chemical is C₁₅H₂₁NO₅.

The characteristics of Boc-O-methyl-L-tyrosine are as followings: (1)ACD/LogP: 2.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.86; (4)ACD/LogD (pH 7.4): -0.65; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 8.43; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 65.07 Å²; (13)Index of Refraction: 1.522; (14)Molar Refractivity: 77.13 cm³; (15)Molar Volume: 252.6 cm³; (16)Polarizability: 30.57×10^-24cm³; (17)Surface Tension: 42.8 dyne/cm; (18)Density: 1.168 g/cm³; (19)Flash Point: 233.2 °C; (20)Enthalpy of Vaporization: 76.18 kJ/mol; (21)Boiling Point: 462 °C at 760 mmHg; (22)Vapour Pressure: 2.47E-09 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(OC)cc1
(2)InChI: InChI=1/C15H21NO5/c1-15(2,3)21-14(19)16-12(13(17)18)9-10-5-7-11(20-4)8-6-10/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)/t12-/m0/s1
(3)InChIKey: SLWWWZWJISHVOU-LBPRGKRZBH

Product Name

Boc-O-methyl-L-tyrosine

Boc-O-methyl-L-tyrosine Specification

Related Products

Hot Products