(15N3)guanidine hydrobromide

• ChemBase编号: 169791
• 分子式: CH6BrN3
• 平均质量: 142.96266669
• 单一同位素质量: 141.96561389
• SMILES: Br.[15NH2]C(=[15NH])[15NH2]
• Canonical SMILES: [15NH2]C(=[15NH])[15NH2].Br
• InChI: InChI=1S/CH5N3.BrH/c2-1(3)4;/h(H5,2,3,4);1H/i2+1,3+1,4+1
• InChIKey: VQNVZLDDLJBKNS-ZNYUTZBJSA-N

名称和登记号

名称

• IUPAC标准名: (^1^5N₃)guanidine hydrobromide
• IUPAC传统名: (^1^5N₃)guanidine hydrobromide
• 别名: Guanidine-15N3 Monohydrobromide; Guanidinium-15N3 Bromide; Guanidine-15N3 Hydrobromide

登记号

• PubChem SID: 162263923
• PubChem CID: 71317165

理论计算性质

• 质子受体: 3
• 质子供体: 3
• LogD (pH = 5.5): -3.6522877
• LogD (pH = 7.4): -3.6514976
• Log P: -1.236839
• 摩尔折射率: 25.8588 cm^3
• 极化性: 5.61125 Å^3
• 极化表面积: 75.89 Å^2
• 可自由旋转的化学键: 0
• 里宾斯基五规则: true

详细说明

Toronto Research Chemicals - G821232

Labelled Guanidine (G821230). It has a good bacterial and fungicidal efficacy when used in low concentration and can also be used as disinfectant.

参考文献

• Castellino, F.J. et al.: Biochem., 7, 4135 (1968)
• Scott, J.N. et al.: J. Phys. Chem. A, 112, 10939 (1968)