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| Name |
(R)-2-N-Cbz-aminopentane-1,5-diol |
EINECS | N/A |
| CAS No. | 478646-28-5 | Density | 1.192g/cm3 |
| PSA | 78.79000 | LogP | 1.43710 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H19NO4 | Boiling Point | 485.2 °C at 760 mmHg |
| Molecular Weight | 253.298 | Flash Point | 247.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
REF DUPL: (S)-benzyl 1,5-dihydroxypentan-2-ylcarbamate;REF DUPL: (R)-2-N-Cbz-amino-pentane-1,5-diol;(R)-(4-Hydroxy-1-hydroxymethylbutyl)carbamic acid benzyl ester;(R)-Benzyl 1,5-dihydroxypentan-2-ylcarbamate; |
(R)-2-N-Cbz-aminopentane-1,5-diol Specification
The (R)-2-N-Cbz-aminopentane-1,5-diol with cas registry number of 478646-28-5, is also named REF DUPL: (S)-benzyl 1,5-dihydroxypentan-2-ylcarbamate ; (R)-2-N-Cbz-aminopentane-1,5-diol .
Physical properties of (R)-2-N-Cbz-aminopentane-1,5-diol :(1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.81; (4)ACD/LogD (pH 7.4): 0.81; (5)ACD/BCF (pH 5.5): 2.42; (6)ACD/BCF (pH 7.4): 2.42; (7)ACD/KOC (pH 5.5): 65.58; (8)ACD/KOC (pH 7.4): 65.58; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 48 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 67.36 cm3; (15)Molar Volume: 212.4 cm3; (16)Polarizability: 26.7×10-24cm3; (17)Surface Tension: 50.4 dyne/cm; (18)Enthalpy of Vaporization: 79.06 kJ/mol; (19)Vapour Pressure: 3.17E-10 mmHg at 25°C .
You can still convert the following datas into molecular structure: (1)SMILES:O=C(OCc1ccccc1)N[C@H](CCCO)CO; (2)InChI:InChI=1/C13H19NO4/c15-8-4-7-12(9-16)14-13(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12,15-16H,4,7-10H2,(H,14,17)/t12-/m1/s1; (3)InChIKey:QONUZQBHASYEAL-GFCCVEGCBT; (4)Std. InChI:InChI=1S/C13H19NO4/c15-8-4-7-12(9-16)14-13(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12,15-16H,4,7-10H2,(H,14,17)/t12-/m1/s1; (5)Std. InChIKey:QONUZQBHASYEAL-GFCCVEGCSA-N.
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