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CAS No.: | 69630-60-0 |
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Name: | H-D-MET-OME HCL |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H13NO2S.HCl |
Molecular Weight: | 199.702 |
Synonyms: | D-Methionine,methyl ester, hydrochloride (9CI);Methyl D-methioninate hydrochloride;H-D-Met-OMe.HCl;H-D-Met-OMe·HCl; |
Melting Point: | 149-150 °C |
Boiling Point: | 240 °C at 760 mmHg |
Flash Point: | 99 °C |
PSA: | 77.62000 |
LogP: | 1.74210 |
The D-Methionine, methylester, hydrochloride (1:1), with CAS registry number 69630-60-0, belongs to the following product categories: (1)Amino Acids; (2)Methionine [Met, M]; (3)Amino Acids and Derivatives; (4)Amino hydrochloride. It has the systematic name of (2R)-1-methoxy-4-(methylsulfanyl)-1-oxobutan-2-aminium chloride. Thia chemical is a kind of crystalline. And it should be stored at the temperature of 0°C.
Physical properties of D-Methionine, methylester, hydrochloride (1:1): (1)ACD/LogP: 0.57; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 51.6 Å2; (7)Enthalpy of Vaporization: 47.69 kJ/mol; (8)Vapour Pressure: 0.0388 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].O=C(OC)[C@H]([NH3+])CCSC
(2)InChI: InChI=1/C6H13NO2S.ClH/c1-9-6(8)5(7)3-4-10-2;/h5H,3-4,7H2,1-2H3;1H/t5-;/m1./s1
(3)InChIKey: MEVUPUNLVKELNV-NUBCRITNBB
(4)Std. InChI: InChI=1S/C6H13NO2S.ClH/c1-9-6(8)5(7)3-4-10-2;/h5H,3-4,7H2,1-2H3;1H/t5-;/m1./s1
(5)Std. InChIKey: MEVUPUNLVKELNV-NUBCRITNSA-N