Cas no 78904-63-9 (Benzene, (dodecylsulfonyl)-)
Benzene, (dodecylsulfonyl)- structure
Product Name:Benzene, (dodecylsulfonyl)-
CAS No:78904-63-9
MF:C18H30O2S
MW:310.494604587555
CID:533706
PubChem ID:11833868
Update Time:2025-04-19
Benzene, (dodecylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, (dodecylsulfonyl)-
- dodecylsulfonylbenzene
- SCHEMBL5963682
- 78904-63-9
- DTXSID90474231
-
- Inchi： 1S/C18H30O2S/c1-2-3-4-5-6-7-8-9-10-14-17-21(19,20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3
- InChI Key： STOYPUWKTQLYDO-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1)(CCCCCCCCCCCC)(=O)=O
Computed Properties
- Exact Mass: 310.19665137g/mol
- Monoisotopic Mass: 310.19665137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 324
- 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: 6.7
- Topological Polar Surface Area: 42.5?2
Benzene, (dodecylsulfonyl)- Related Literature
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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