methylphosphonoyl difluoride

• ChemBase编号: 128387
• 分子式: CH3F2OP
• 平均质量: 100.0044874
• 单一同位素质量: 99.98895779
• SMILES: CP(=O)(F)F
• Canonical SMILES: CP(=O)(F)F
• InChI: InChI=1S/CH3F2OP/c1-5(2,3)4/h1H3
• InChIKey: PQIOSYKVBBWRRI-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: methylphosphonoyl difluoride
• IUPAC传统名: methylphosphonyl difluoride
• 别名: Methylphosphonyl difluoride; Methylphosphonoyl difluoride; Methylphosphonyl difluoride

登记号

• CAS号: 676-99-3
• Beilstein号: 4-04-00-03508
• PubChem SID: 162222694
• PubChem CID: 69610
• Chemspider ID: 62813
• 医学主题词(MeSH): Methylphosphonic difluoride
• 维基百科标题: Methylphosphonyl_difluoride

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 0.1261625
• LogD (pH = 7.4): 0.1261625
• Log P: 0.1261625
• 摩尔折射率: 15.0514 cm^3
• 极化性: 5.8692665 Å^3
• 极化表面积: 17.07 Å^2
• 可自由旋转的化学键: 0
• 里宾斯基五规则: true