N-Cbz-N'-Boc-D-2,3-diaminopropionic acid supplier

Name
N-α-Z-N-β-Boc-D-2,3-diaminopropionic acid
EINECS 1533716-785-6
CAS No. 62234-36-0
Article Data22
CAS DataBase
Density 1.235 g/cm³
Solubility
Melting Point 139-140 °C
Formula C₁₆H₂₂N₂O₆
Boiling Point 548.7 °C at 760 mmHg
Molecular Weight 338.36
Flash Point 285.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2R)-2-[(Benzyloxycarbonyl)amino]-3-[(tert-butoxycarbonyl)amino]propionicacid;N-[(Benzyloxy)carbonyl]-3-[(tert-butoxycarbonyl)amino]-D-alanine;
PSA
LogP

N-Cbz-N'-Boc-D-2,3-diaminopropionic acid Specification

The CAS register number of D-Alanine,3-[[(1,1-dimethylethoxy)carbonyl]amino]-N-[(phenylmethoxy)carbonyl]- is 62234-36-0. It also can be called as N-Cbz-N'-Boc-D-2,3-diaminopropionic acid and the systematic name about this chemical is 3-{[(benzyloxy)carbonyl]amino}-N-(tert-butoxycarbonyl)alanine. The molecular formula about this chemical is C₁₆H₂₂N₂O₆and the molecular weight is 338.36.

Physical properties about D-Alanine,3-[[(1,1-dimethylethoxy)carbonyl]amino]-N-[(phenylmethoxy)carbonyl]- are: (1)ACD/LogP: 3.24; (2)ACD/LogD (pH 5.5): 0.83; (3)ACD/LogD (pH 7.4): -0.41; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.32; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 8; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 85.38Å²; (12)Index of Refraction: 1.533; (13)Molar Refractivity: 85.09 cm³; (14)Molar Volume: 273.9 cm³; (15)Polarizability: 33.73x10^-24cm³; (16)Surface Tension: 48.1 dyne/cm; (17)Enthalpy of Vaporization: 87.17 kJ/mol; (18)Boiling Point: 548.7 °C at 760 mmHg; (19)Vapour Pressure: 7.12E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)NC(C(=O)O)CNC(=O)OCc1ccccc1
(2)InChI: InChI=1/C16H22N2O6/c1-16(2,3)24-15(22)18-12(13(19)20)9-17-14(21)23-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,22)(H,19,20)
(3)InChIKey: QKMSMVGTLTVHLK-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C16H22N2O6/c1-16(2,3)24-15(22)18-12(13(19)20)9-17-14(21)23-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,22)(H,19,20)
(5)Std. InChIKey: QKMSMVGTLTVHLK-UHFFFAOYSA-N

Product Name

N-α-Z-N-β-Boc-D-2,3-diaminopropionic acid

N-Cbz-N'-Boc-D-2,3-diaminopropionic acid Specification

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