Boc-D-Tyr-OMe supplier | CasNO.76757-90-9

Name
BOC-D-TYR-OME
EINECS 201-525-2
CAS No. 76757-90-9
Article Data14
CAS DataBase
Density 1.169 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₁NO₅
Boiling Point 452.7 °C at 760 mmHg
Molecular Weight 295.335
Flash Point 227.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms D-N-tert-Butoxycarbonyltyrosinemethyl ester;Methyl (R)-2-[(tert-Butoxycarbonyl)amino]-3-(4-hydroxyphenyl)propionate;N-BOC-D-tyrosine methyl ester;N-tert-Butoxycarbonyl-D-tyrosine methyl ester;D-tyrosine, N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester;Methyl N-(tert-butoxycarbonyl)-D-tyrosinate;BOC-D-TYR-OME;Boc-D-tyrosine methyl ester;
PSA 84.86000
LogP 2.39190

Boc-D-Tyr-OMe Specification

The Boc-D-Tyr-OMe, with the CAS registry number 76757-90-9, has the systematic name of methyl N-(tert-butoxycarbonyl)-D-tyrosinate. It should be stored at -15°C in the dry and sealed containers. And the molecular formula of the chemical is C₁₅H₂₁NO₅.

The characteristics of Boc-D-Tyr-OMe are as followings: (1)ACD/LogP: 2.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.65; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 60.42; (6)ACD/BCF (pH 7.4): 60.13; (7)ACD/KOC (pH 5.5): 655.48; (8)ACD/KOC (pH 7.4): 652.35; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 65.07 Å²; (13)Index of Refraction: 1.523; (14)Molar Refractivity: 77.18 cm³; (15)Molar Volume: 252.4 cm³; (16)Polarizability: 30.59×10^-24cm³; (17)Surface Tension: 43.2 dyne/cm; (18)Density: 1.169 g/cm³; (19)Flash Point: 227.6 °C; (20)Enthalpy of Vaporization: 73.93 kJ/mol; (21)Boiling Point: 452.7 °C at 760 mmHg; (22)Vapour Pressure: 8.19E-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)OC)Cc1ccc(O)cc1
(2)InChI: InChI=1/C15H21NO5/c1-15(2,3)21-14(19)16-12(13(18)20-4)9-10-5-7-11(17)8-6-10/h5-8,12,17H,9H2,1-4H3,(H,16,19)/t12-/m1/s1
(3)InChIKey: NQIFXJSLCUJHBB-GFCCVEGCBF

Product Name

BOC-D-TYR-OME

Boc-D-Tyr-OMe Specification

Related Products

Hot Products