Cas no 38293-11-7 (Cyclohexanone, 2-(propylthio)-)
38293-11-7 structure
Product Name:Cyclohexanone, 2-(propylthio)-
CAS No:38293-11-7
MF:C9H16OS
MW:172.287741661072
CID:1489061
PubChem ID:13128893
Update Time:2025-04-21
Cyclohexanone, 2-(propylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 2-(propylthio)-
- 2-propylsulfanylcyclohexan-1-one
- 2-(Propylsulfanyl)cyclohexan-1-one
- SCHEMBL8879148
- AKOS009985199
- DTXSID90520429
- 38293-11-7
-
- Inchi： 1S/C9H16OS/c1-2-7-11-9-6-4-3-5-8(9)10/h9H,2-7H2,1H3
- InChI Key： QVCKRSGYCBWDRE-UHFFFAOYSA-N
- SMILES： S(CCC)C1C(CCCC1)=O
Computed Properties
- Exact Mass: 172.09228
- Monoisotopic Mass: 172.09218630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 134
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 42.4?2
Experimental Properties
- PSA: 17.07
Cyclohexanone, 2-(propylthio)- Related Literature
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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