(1,4-dioxan-2-ylmethyl)hydrazine

• ChemBase编号: 309357
• 分子式: C5H12N2O2
• 平均质量: 132.16098
• 单一同位素质量: 132.08987763
• SMILES: O1C(CNN)COCC1
• Canonical SMILES: NNCC1COCCO1
• InChI: InChI=1S/C5H12N2O2/c6-7-3-5-4-8-1-2-9-5/h5,7H,1-4,6H2
• InChIKey: WPMVMYLFTXKTGI-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (1,4-dioxan-2-ylmethyl)hydrazine
• IUPAC传统名: (1,4-dioxan-2-ylmethyl)hydrazine
• 别名: (1,4-dioxan-2-ylmethyl)hydrazine

登记号

• MDL号: MFCD17224940

理论计算性质

• 质子受体: 4
• 质子供体: 2
• LogD (pH = 5.5): -1.34572
• LogD (pH = 7.4): -1.0218928
• Log P: -1.0158231
• 摩尔折射率: 44.6839 cm^3
• 极化性: 13.481894 Å^3
• 极化表面积: 56.51 Å^2