Cas no 70399-06-3 (Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]-)
![Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/70500/70399-06-3x500.png)
70399-06-3 structure
Product Name:Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]-
CAS No:70399-06-3
MF:C11H16O4S2
MW:276.372341156006
CID:547286
PubChem ID:12763268
Update Time:2025-04-19
Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]-
- 1-ethylsulfonyl-4-propan-2-ylsulfonylbenzene
- DTXSID70509272
- 1-(Ethanesulfonyl)-4-(propane-2-sulfonyl)benzene
- 70399-06-3
-
- Inchi： 1S/C11H16O4S2/c1-4-16(12,13)10-5-7-11(8-6-10)17(14,15)9(2)3/h5-9H,4H2,1-3H3
- InChI Key： ODQCRCGCDMYHMF-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)S(CC)(=O)=O)(C(C)C)(=O)=O
Computed Properties
- Exact Mass: 276.04908
- Monoisotopic Mass: 276.04900133g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 429
- 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: 85?2
Experimental Properties
- PSA: 68.28
Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
70399-06-3 (Benzene, 1-(ethylsulfonyl)-4-[(1-methylethyl)sulfonyl]-) Related Products
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