主记录
Thionisoxetine
- CAS
- 155273-01-1
- PubChem CID
- 166639497
- SMILES
- CNCC[C@H](C1=CC=CC=C1)OC2=C(C=CCC2)SC
- 分子式
- C17H23NOS
- 分子量
- 289.444
- 精确分子量
- 289.15
- InChI
- InChI=1S/C17H23NOS/c1-18-13-12-15(14-8-4-3-5-9-14)19-16-10-6-7-11-17(16)20-2/h3-5,7-9,11,15,18H,6,10,12-13H2,1-2H3/t15-/m1/s1
- InChIKey
- WHHMKNJQCCUPDG-OAHLLOKOSA-N
- LogP
- 4.2784
- TPSA
- 21.26
名称与别名
- Thionisoxetine
- 155273-01-1