methyl 2-aminoacetate hydrochloride

• ChemBase编号: 104803
• 分子式: C3H8ClNO2
• 平均质量: 125.55412
• 单一同位素质量: 125.02435618
• SMILES: Cl.COC(=O)CN
• Canonical SMILES: COC(=O)CN.Cl
• InChI: InChI=1S/C3H7NO2.ClH/c1-6-3(5)2-4;/h2,4H2,1H3;1H
• InChIKey: COQRGFWWJBEXRC-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: methyl 2-aminoacetate hydrochloride
• IUPAC传统名: methyl 2-aminoacetate hydrochloride
• 别名: 甘氨酸甲酯 盐酸盐; 甘氨酸甲酯.盐酸盐; methyl 2-aminoacetate hydrochloride; Glycine methyl ester hydrochloride; Methyl glycinate; GLYCINE METHYL ESTER HYDROCHLORIDE; H-Gly-OMe.HCl; Aminoacetic Acid Methyl Ester Hydrochloride; Glycinate Methyl Ester Hydrochloride; Glycine Methyl Ester Monohydrochloride; Methyl 2-Aminoacetate Hydrochloride; Methyl Aminoacetate Hydrochloride; Methyl Glycinate Hydrochloride; Methyl α-Aminoacetate Hydrochloride

登记号

• CAS号: 5680-79-5
• EC号: 227-139-1
• MDL号: MFCD00012870
• Beilstein号: 3593644
• PubChem SID: 24873337; 162091838; 24895262
• PubChem CID: 122755

理论计算性质

• 质子受体: 2
• 质子供体: 1
• LogD (pH = 5.5): -2.5870519
• LogD (pH = 7.4): -1.1744462
• Log P: -1.0015815
• 摩尔折射率: 20.7725 cm^3
• 极化性: 8.593669 Å^3
• 极化表面积: 52.32 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true

分子性质

理化性质

• 熔点: 175 °C (dec.)(lit.); 175-176 °C (dec.); ca 175°C dec.
• 密度: 1.000

安全信息

• 保存条件: 0°C
• 保存注意事项: Hygroscopic
• 德国WGK号: 3
• TSCA收录: 否
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

产品相关信息

• 纯度: ≥99.0% (AT); 98%; 99%
• 级别: puriss.
• 成盐信息: HCl
• 燃烧残渣: ≤0.05%
• 线性分子式: NH2CH2COOCH3 · HCl

详细说明

MP Biomedicals - 02157245

Hydrochloride
Crystalline

Sigma Aldrich - G6600

包装
100, 500 g in poly bottle
5 g in glass bottle

Toronto Research Chemicals - G625235

A Glycine ester, a non-essential amino acid for human development.

参考文献

• Tamura, M., et al.: Peptide Chem., 26, 35 (1989)