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Alanine, 2-methyl-,ethyl ester, hydrochloride (1:1) (17288-15-2)

Identification
Name:Alanine, 2-methyl-,ethyl ester, hydrochloride (1:1)
Synonyms:Alanine,2-methyl-, ethyl ester, hydrochloride (8CI,9CI);Ethyl2-amino-2-methylpropanoate hydrochloride;Ethyl a-aminoisobutyrate hydrochloride;a-Aminoisobutyric acid ethyl esterhydrochloride;a-Methylalanineethyl ester hydrochloride;
CAS:17288-15-2
Molecular Formula: C6H13NO2.HCl
Molecular Weight: 167.63
InChI: InChI=1/C6H13NO2.ClH/c1-4-9-5(8)6(2,3)7;/h4,7H2,1-3H3;1H
Molecular Structure: (C6H13NO2.HCl) Alanine,2-methyl-, ethyl ester, hydrochloride (8CI,9CI);Ethyl2-amino-2-methylpropanoate hydrochlorid...
Properties
Specification:

The Ethyl 2-amino-2-methylpropanoate hydrochloride, with the cas registry number 17288-15-2, has the systematic name of ethyl 2-methylalaninate hydrochloride. And the molecular formula of the chemical is C6H14ClNO2. This chemical should be stored at the temperature of 0-5°C.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 6; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 52.32 Å2; (11)Flash Point: 69.5 °C; (12)Enthalpy of Vaporization: 43.63 kJ/mol; (13)Boiling Point: 191.4 °C at 760 mmHg; (14)Vapour Pressure: 0.438 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cl.CC(C)(N)C(=O)OCC
(2)InChI: InChI=1/C6H13NO2.ClH/c1-4-9-5(8)6(2,3)7;/h4,7H2,1-3H3;1H
(3)InChIKey: YREPHXXOTHNLEV-UHFFFAOYAB

Safety Data