Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- O=C1OCCC1=P(c1ccccc1)(c1ccccc1)c1ccccc1
- InChIKey
- JUKRJGQYUNADDD-UHFFFAOYSA-N
- 分子式
- C22H19O2P
- 平均分子量
- 346.4 g/mol
- 单同位素质量
- 346.11226684
COMPUTED
结构计算性质
- XLogP
- 3.7
- 极性表面积
- 26.3 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 25
- 形式电荷
- 0
- 复杂度
- 468
ALIASES
名称与别名
2(3H)-Furanone, 3-(triphenylphosphoranylidene)-5HYJ564RMVgamma-Butyrolactonylidene triphenyl phosphorane2(3H)-Furanone, dihydro-3-(triphenylphosphoranylidene)-NSC 100769BRN 12609393-(triphenyl-lambda5-phosphanylidene)oxolan-2-one2-(Triphenylphosphoranylidene)-gamma-butyrolactoneNSC-100769alpha-(Triphenylphosphoranylidene)-gamma-butyrolactoneDTXSID50188488Dihydro-3-(triphenylphosphoranylidene)-2(3H)-furanone3-(TRIPHENYL-.LAMBDA.5-PHOSPHANYLIDENE)OXOLAN-2-ONERefChem:80473DTXCID801109792(3H)-Furanone, dihydro-3-(triphenylphosphoranylidene)-(9CI)34932-07-53-(triphenylphosphoranylidene)dihydro-2(3H)-furanoneUNII-5HYJ564RMVSCHEMBL3603157
REACTIONS
参与反应
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