triphenyl(propan-2-yl)phosphanium bromide

• ChemBase编号: 85342
• 分子式: C21H22BrP
• 平均质量: 385.277141
• 单一同位素质量: 384.06424933
• SMILES: [P+](c1ccccc1)(c1ccccc1)(c1ccccc1)C(C)C.[Br-]
• Canonical SMILES: CC([P+](c1ccccc1)(c1ccccc1)c1ccccc1)C.[Br-]
• InChI: InChI=1S/C21H22P.BrH/c1-18(2)22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-18H,1-2H3;1H/q+1;/p-1
• InChIKey: HSOZCYIMJQTYEX-UHFFFAOYSA-M

名称和登记号

名称

• IUPAC标准名: triphenyl(propan-2-yl)phosphanium bromide
• IUPAC传统名: isopropyltriphenylphosphanium bromide
• 别名: Triphenyl(propan-2-yl)phosphonium bromide; Isopropyl(triphenyl)phosphonium bromide; Isopropyltriphenylphosphonium Bromide; (1-Methylethyl)triphenyl-phosphonium Bromide; (1-Methylethyl)triphenylphosphonium Bromide; NSC 113130; 2-Propyltriphenylphosphonium Bromide

登记号

• CAS号: 1530-33-2
• MDL号: MFCD00064807
• PubChem SID: 162072458
• PubChem CID: 2795292

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 5.297396
• LogD (pH = 7.4): 5.297396
• Log P: 5.297396
• 摩尔折射率: 96.4378 cm^3
• 极化性: 38.127544 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 4
• 里宾斯基五规则: false

分子性质

理化性质

• 溶解度: Methanol
• 外观: WHite Solid

安全信息

• 保存注意事项: Irritant

详细说明

Toronto Research Chemicals - P838335

Shows antiviral activity.