2-methyl-1-(morpholin-4-yl)propan-2-amine

• ChemBase编号: 17030
• 分子式: C8H18N2O
• 平均质量: 158.24132
• 单一同位素质量: 158.14191321
• SMILES: N1(CC(N)(C)C)CCOCC1
• Canonical SMILES: CC(CN1CCOCC1)(N)C
• InChI: InChI=1S/C8H18N2O/c1-8(2,9)7-10-3-5-11-6-4-10/h3-7,9H2,1-2H3
• InChIKey: JCXYZQUYVNLCTG-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-methyl-1-(morpholin-4-yl)propan-2-amine
• IUPAC传统名: 2-methyl-1-(morpholin-4-yl)propan-2-amine
• 别名: 2-methyl-1-morpholino-2-propanamine; 2-Methyl-1-morpholinopropan-2-amine; 1,1-Dimethyl-2-morpholin-4-yl-ethylamine; (1,1-dimethyl-2-morpholin-4-ylethyl)amine; 1,1-Dimethyl-2-morpholinoethylamine; 4-(2-Amino-2-methyl)propylmorpholine 97%

登记号

• CAS号: 6105-75-5
• MDL号: MFCD01714129
• PubChem SID: 160980337
• PubChem CID: 201497

理论计算性质

• 质子受体: 3
• 质子供体: 1
• LogD (pH = 5.5): -3.6143422
• LogD (pH = 7.4): -2.4861557
• Log P: -0.1281631
• 摩尔折射率: 46.0694 cm^3
• 极化性: 18.481222 Å^3
• 极化表面积: 38.49 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true

分子性质

安全信息

• 保存注意事项: Corrosive/Air Sensitive/Store under Argon; IRRITANT
• TSCA收录: false

产品相关信息

• 纯度: 95+%; 97%