(naphthalen-2-ylmethyl)hydrazine hydrochloride

• ChemBase编号: 89945
• 分子式: C11H13ClN2
• 平均质量: 208.68732
• 单一同位素质量: 208.07672611
• SMILES: N(Cc1cc2ccccc2cc1)N.Cl
• Canonical SMILES: NNCc1ccc2c(c1)cccc2.Cl
• InChI: InChI=1S/C11H12N2.ClH/c12-13-8-9-5-6-10-3-1-2-4-11(10)7-9;/h1-7,13H,8,12H2;1H
• InChIKey: IAKMYKIDUYWYHW-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (naphthalen-2-ylmethyl)hydrazine hydrochloride
• IUPAC传统名: (naphthalen-2-ylmethyl)hydrazine hydrochloride
• 别名: (2-Naphthylmethyl)hydrazine hydrochloride

登记号

• MDL号: MFCD08059573
• PubChem SID: 162076800
• PubChem CID: 44119567

理论计算性质

• 质子受体: 2
• 质子供体: 2
• LogD (pH = 5.5): 1.6900167
• LogD (pH = 7.4): 1.9003699
• Log P: 1.9038355
• 摩尔折射率: 65.9585 cm^3
• 极化性: 22.676706 Å^3
• 极化表面积: 38.05 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true