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| CAS No.: | 2776-60-5 |
|---|---|
| Name: | GLYCYLGLYCINE METHYL ESTER HYDROCHLORIDE |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C5H10N2O3·ClH |
| Molecular Weight: | 182.607 |
| Synonyms: | Glycine,N-glycyl-, methyl ester, hydrochloride (7CI);Glycine, N-glycyl-, methyl ester,monohydrochloride (8CI);Glycine, glycyl-, methyl ester, monohydrochloride(9CI);Glycylglycine methyl ester hydrochloride;Methyl glycylglycinatehydrochloride;H-Gly-Gly-OMe·HCl; |
| Boiling Point: | 323.5 °C at 760 mmHg |
| Flash Point: | 149.4 °C |
| PSA: | 81.42000 |
| LogP: | 0.12750 |
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Specification
The Glycine, glycyl-,methyl ester, hydrochloride (1:1), with the CAS registry number 2776-60-5, is also known as H-Gly-Gly-OMe·HCl. This chemical's molecular formula is C5H10N2O3·ClH and formula weight is 182.61. What's more, its IUPAC name is methyl 2-[(2-aminoacetyl)amino]acetate hydrochloride.
Physical properties of Glycine, glycyl-,methyl ester, hydrochloride (1:1) are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 5; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 81.42 Å2; (6)Flash Point: 149.4 °C; (7)Enthalpy of Vaporization: 57.67 kJ/mol; (8)Boiling Point: 323.5 °C at 760 mmHg; (9)Vapour Pressure: 0.00019 mmHg at 25°C.
Preparation: this chemical can be prepared by methanol, N-glycyl-glycine at the temperature of 21°C. This reaction will need reagent thionyl chloride. The yield is about 90%.
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Uses of Glycine, glycyl-,methyl ester, hydrochloride (1:1): it can be used to produce [2-(benzhydrylidene-amino)-acetylamino]-acetic acid methyl ester at the ambient temperature. It will need solvent CH2Cl2 with the reaction time of 24 hours. The yield is about 91%.
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You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)CNC(=O)CN.Cl
(2)InChI: InChI=1S/C5H10N2O3.ClH/c1-10-5(9)3-7-4(8)2-6;/h2-3,6H2,1H3,(H,7,8);1H
(3)InChIKey: RZOAGVGJBLVHIZ-UHFFFAOYSA-N