Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Ethyl D-valinate hydrochloride |
EINECS | 277-635-7 |
CAS No. | 73913-64-1 | Density | N/A |
PSA | 52.32000 | LogP | 2.03510 |
Solubility | N/A | Melting Point |
120oC |
Formula | C7H16ClNO2 | Boiling Point | 212.5 °C at 760 mmHg |
Molecular Weight | 181.663 | Flash Point | 82.3 °C |
Transport Information | N/A | Appearance | White crystalline powde |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
D-Valine,ethyl ester, hydrochloride (9CI);Ethyl D-valinate hydrochloride; |
Article Data | 2 |
The D-Valine, ethyl ester,hydrochloride (1:1), with CAS registry number 73913-64-1, belongs to the following product category: Amino hydrochloride. Its systematic name and its IUPAC name are the same, which is ethyl (2R)-2-amino-3-methyl-butanoate hydrochloride. This chemical should be stored at the temperature of 0°C.
Physical properties of D-Valine, ethyl ester,hydrochloride (1:1): (1)/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.14; (4)#H bond acceptors: 3; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 5; (7)Polar Surface Area: 52.32 Å2; (8)Enthalpy of Vaporization: 45.79 kJ/mol; (9)Vapour Pressure: 0.143 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.CC(C)[C@@H](N)C(=O)OCC
(2)InChI: InChI=1/C7H15NO2.ClH/c1-4-10-7(9)6(8)5(2)3;/h5-6H,4,8H2,1-3H3;1H/t6-;/m1./s1
(3)InChIKey: PQGVTLQEKCJXKF-FYZOBXCZBY
(4)Std. InChI: InChI=1S/C7H15NO2.ClH/c1-4-10-7(9)6(8)5(2)3;/h5-6H,4,8H2,1-3H3;1H/t6-;/m1./s1
(5)Std. InChIKey: PQGVTLQEKCJXKF-FYZOBXCZSA-N