麦角异克碱

• 常用名: 麦角异克碱
• 英文名: Ergocristinine
• CAS号: 511-07-9
• 分子量: 609.715
• 密度: 1.4±0.1 g/cm3
• 沸点: 912.8±65.0 °C at 760 mmHg
• 分子式: C₃₅H₃₉N₅O₅
• 熔点: N/A
• 闪点: 505.8±34.3 °C

麦角异克碱名称

• 中文名: 麦角异克碱
• 英文名: (5'α,8α)-5'-Benzyl-12'-hydroxy-2'-isopropyl-3',6',18-trioxoergota m

麦角异克碱物理化学性质

• 密度: 1.4±0.1 g/cm3
• 沸点: 912.8±65.0 °C at 760 mmHg
• 分子式: C₃₅H₃₉N₅O₅
• 分子量: 609.715
• 闪点: 505.8±34.3 °C
• 精确质量: 609.295105
• PSA: 121.70000
• LogP: 4.45
• InChIKey: HEFIYUQVAZFDEE-NASJTFDLSA-N
• SMILES: CC(C)C1(NC(=O)C2C=C3c4cccc5[nH]cc(c45)CC3N(C)C2)OC2(O)C3CCCN3C(=O)C(Cc3ccccc3)N2C1=O
• 蒸汽压: 0.0±0.3 mmHg at 25°C
• 折射率: 1.721

麦角异克碱安全信息

• 危险品运输编码: UN 1544
• 包装等级: III
• 危险类别: 6.1(b)

麦角异克碱英文别名

• 12'-Hydroxy-2'-(1-methylethyl)-5'a-(phenylmethyl)-8a-ergotaman-3',6',18-trione
• Ergocristinin
• 5-Benzyl-1,3-dimethyluracil
• Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (5'α,8α)-
• 5'-benzyl-12'-hydroxy-2'-isopropyl-ergotamane-18,3',6'-trione
• (5'α,8α)-5'-Benzyl-12'-hydroxy-2'-isopropyl-3',6',18-trioxoergotaman
• Ergotaman, 12'-hydroxy-2'-(1-methylethyl)-3',6',18-trioxo-5'-(phenylmethyl)-, (5'α,8α)-
• (8α)-5'α-Benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
• Ergocristinine
• 5-benzyl-1,3-dimethyl-1H-pyrimidine-2,4-dione