Cas no 923266-26-6 (Benzaldehyde, 3-fluoro-5-(methylsulfonyl)-)
923266-26-6 structure
Product Name:Benzaldehyde, 3-fluoro-5-(methylsulfonyl)-
CAS No:923266-26-6
MF:C8H7FO3S
MW:202.202784776688
CID:753459
PubChem ID:57652523
Update Time:2025-04-19
Benzaldehyde, 3-fluoro-5-(methylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 3-fluoro-5-(methylsulfonyl)-
- 3-fluoro-5-methylsulfonylbenzaldehyde
- 923266-26-6
- ZOFISFULBDNTHZ-UHFFFAOYSA-N
- DTXSID90727436
- 3-fluoro-5-(methylsulfonyl)benzaldehyde
- SCHEMBL2264873
- 3-Fluoro-5-(methanesulfonyl)benzaldehyde
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- Inchi: 1S/C8H7FO3S/c1-13(11,12)8-3-6(5-10)2-7(9)4-8/h2-5H,1H3
- InChI Key: ZOFISFULBDNTHZ-UHFFFAOYSA-N
- SMILES: S(C)(C1C=C(C=C(C=O)C=1)F)(=O)=O
Computed Properties
- Exact Mass: 202.00999342g/mol
- Monoisotopic Mass: 202.00999342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 280
- 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: 0.7
- Topological Polar Surface Area: 59.6?2
Benzaldehyde, 3-fluoro-5-(methylsulfonyl)- Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
923266-26-6 (Benzaldehyde, 3-fluoro-5-(methylsulfonyl)-) Related Products
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- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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