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CAS No.: | 32668-14-7 |
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Name: | L-GLUTAMINE METHYL ESTER HYDROCHLORIDE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H13ClN2O3 |
Molecular Weight: | 196.634 |
Synonyms: | Glutamine,methyl ester, monohydrochloride, L- (8CI);L-Glutamine, methyl ester,monohydrochloride (9CI);L-Glutamine methyl ester hydrochloride; |
EINECS: | 672-313-6 |
Boiling Point: | 369.9 °C at 760mmHg |
Flash Point: | 177.5 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36 |
Safety: | 26 |
PSA: | 95.41000 |
LogP: | 0.95480 |
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The L-Glutamine methyl ester hydrochloride, with the CAS registry number 32668-14-7, is also known as (S)-2-Amino-4-carbamoyl-butyric acid methyl ester hydrochloride. It belongs to the product category of Chiral. This chemical's molecular formula is C6H13ClN2O3 and molecular weight is 196.63. What's more, its systematic name is called Methyl (2S)-2,5-diamino-5-oxo-pentanoate hydrochloride.
Physical properties about L-Glutamine methyl ester hydrochloride are: (1) # of Rule of 5 Violations: 0; (2) #H bond acceptors: 5; (3) #H bond donors: 4; (4) #Freely Rotating Bonds: 6; (5) Polar Surface Area: 95.41 Å2; (6) Flash Point: 177.5 °C; (7) Enthalpy of Vaporization: 62.89 kJ/mol; (8) Boiling Point: 369.9 °C at 760 mmHg; (9) Vapour Pressure: 7.86E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.N[C@@H](CCC(N)=O)C(=O)OC
(2) InChI: InChI=1/C6H12N2O3.ClH/c1-11-6(10)4(7)2-3-5(8)9;/h4H,2-3,7H2,1H3,(H2,8,9);1H/t4-;/m0./s1
(3) InChIKey: HGYBXODOMJPMNO-WCCKRBBIBI