Cas no 18615-62-8 (Dihydro-5,5-dimethylthiopyran-3(4H)-one)
18615-62-8 structure
Product Name:Dihydro-5,5-dimethylthiopyran-3(4H)-one
CAS No:18615-62-8
MF:C7H12OS
MW:144.234580993652
CID:1070085
PubChem ID:59332748
Update Time:2025-04-20
Dihydro-5,5-dimethylthiopyran-3(4H)-one Chemical and Physical Properties
Names and Identifiers
-
- Dihydro-5,5-dimethylthiopyran-3(4H)-one
- 5,5-Dimethyl-3-thianon
- 5,5-dimethyl-dihydro-thiopyran-3-one
- 5,5-dimethyl-tetrahydrothiopyran-3-one
- AGN-PC-0CUT6P
- FT-0685953
- RP08899
- SureCN4970750
- 5,5-diMethyldihydrothiopyran-3-one
- starbld0001737
- SCHEMBL4970750
- 18615-62-8
- DTXSID20731546
- 5,5-Dimethyldihydro-2H-thiopyran-3(4H)-one
- AKOS015950430
- W-206343
- 5,5-dimethylthian-3-one
-
- MDL： MFCD18325142
- Inchi： 1S/C7H12OS/c1-7(2)3-6(8)4-9-5-7/h3-5H2,1-2H3
- InChI Key： XFNFKMFAIBWJOM-UHFFFAOYSA-N
- SMILES： S1CC(CC(C)(C)C1)=O
Computed Properties
- Exact Mass: 144.06088618g/mol
- Monoisotopic Mass: 144.06088618g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 129
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 42.4?2
Dihydro-5,5-dimethylthiopyran-3(4H)-one Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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