Cas no 105917-77-9 (2,3-dichloro-4-methylsulfonylbenzoic Acid)
105917-77-9 structure
Product Name:2,3-dichloro-4-methylsulfonylbenzoic Acid
CAS No:105917-77-9
MF:C8H6Cl2O4S
MW:269.101839542389
CID:1166485
PubChem ID:2786943
Update Time:2025-04-20
2,3-dichloro-4-methylsulfonylbenzoic Acid Chemical and Physical Properties
Names and Identifiers
-
- 2,3-dichloro-4-methylsulfonylbenzoic Acid
- SCHEMBL7807426
- OGKHGNNGBKDXOK-UHFFFAOYSA-N
- Benzoic acid, 2,3-dichloro-4-(methylsulfonyl)-
- 105917-77-9
- DTXSID90383051
-
- Inchi: 1S/C8H6Cl2O4S/c1-15(13,14)5-3-2-4(8(11)12)6(9)7(5)10/h2-3H,1H3,(H,11,12)
- InChI Key: OGKHGNNGBKDXOK-UHFFFAOYSA-N
- SMILES: ClC1C(=C(C(=O)O)C=CC=1S(C)(=O)=O)Cl
Computed Properties
- Exact Mass: 267.9363852g/mol
- Monoisotopic Mass: 267.9363852g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 348
- 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: 1.9
- Topological Polar Surface Area: 79.8?2
2,3-dichloro-4-methylsulfonylbenzoic Acid Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
105917-77-9 (2,3-dichloro-4-methylsulfonylbenzoic Acid) Related Products
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