Products Categories
CAS No.: | 104719-63-3 |
---|---|
Name: | BOC-D-GLU(OTBU)-OH |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C14H25NO6 |
Molecular Weight: | 303.356 |
Synonyms: | (2R)-5-tert-Butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoicacid;N-(tert-Butoxycarbonyl)-D-glutamic acid 5-tert-butyl ester;(2R)-5-tert-butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid (non-preferred name);D-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, 5-(1,1-dimethylethyl) ester;Boc-Glu(OtBu)-OH; Boc-L-glutamic acid 5-tert-butyl ester;Boc-L-glutamic acid 5-tert-butyl ester; |
Density: | 1.121 g/cm3 |
Boiling Point: | 449.8 °C at 760 mmHg |
Flash Point: | 225.8 °C |
PSA: | 101.93000 |
LogP: | 2.47710 |
What can I do for you?
Get Best Price
The Boc-D-Glu(OtBu)-OH, with the CAS registry number 104719-63-3, has the systematic name of (2R)-5-tert-butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid (non-preferred name). It belongs to the following product categories: Boc-Amino Acids and Derivative; Boc-Amino acid series. And it should be stored at 2-8°C. The molecular formula of the chemical is C14H25NO6.
The characteristics of Boc-D-Glu(OtBu)-OH are as followings: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.69; (4)ACD/LogD (pH 7.4): -0.75; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 6.06; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 82.14 Å2; (13)Index of Refraction: 1.47; (14)Molar Refractivity: 75.5 cm3; (15)Molar Volume: 270.5 cm3; (16)Polarizability: 29.93×10-24cm3; (17)Surface Tension: 38.9 dyne/cm; (18)Density: 1.121 g/cm3; (19)Flash Point: 225.8 °C; (20)Enthalpy of Vaporization: 77.66 kJ/mol; (21)Boiling Point: 449.8 °C at 760 mmHg; (22)Vapour Pressure: 2.42E-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)CCC(=O)OC(C)(C)C
(2)InChI: InChI=1/C14H25NO6/c1-13(2,3)20-10(16)8-7-9(11(17)18)15-12(19)21-14(4,5)6/h9H,7-8H2,1-6H3,(H,15,19)(H,17,18)/t9-/m1/s1
(3)InChIKey: YGSRAYJBEREVRB-SECBINFHBH