Propanoic acid,2-methyl-,1,2,3,4-tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-6,7-isoquinolinediyl ester (9CI)

• 常用名: Propanoic acid,2-methyl-,1,2,3,4-tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-6,7-isoquinolinediyl ester (9CI)
• 英文名: Propanoic acid,2-methyl-,1,2,3,4-tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-6,7-isoquinolinediyl ester (9CI)
• CAS号: 80129-08-4
• 分子量: 433.525
• 密度: 1.4±0.1 g/cm3
• 沸点: 600.7±65.0 °C at 760 mmHg
• 分子式: C₂₀H₂₇N₅O₄S
• 熔点: N/A
• 闪点: 317.1±34.3 °C

名称

• 英文名: 1-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,2,3,4-tetrahydroisoquinoline-6,7-diyl bis(2-methylpropanoate)

物理化学性质

• 密度: 1.4±0.1 g/cm3
• 沸点: 600.7±65.0 °C at 760 mmHg
• 分子式: C₂₀H₂₇N₅O₄S
• 分子量: 433.525
• 闪点: 317.1±34.3 °C
• 精确质量: 433.178375
• LogP: 1.56
• InChIKey: OIIKNXKFDZYDLI-UHFFFAOYSA-N
• SMILES: CC(C)C(=O)Oc1cc2c(cc1OC(=O)C(C)C)C(CSc1nnnn1C)NCC2
• 蒸汽压: 0.0±1.7 mmHg at 25°C
• 折射率: 1.645

英文别名

• 1-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,2,3,4-tetrahydroisoquinoline-6,7-diyl bis(2-methylpropanoate)
• Propanoic acid, 2-methyl-, 1,2,3,4-tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-6,7-isoquinolinediyl ester