Cas no 52277-26-6 (Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl-)
52277-26-6 structure
Product Name:Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl-
Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl-
- o-Cresolsulfonicacid
- 2-hydroxy-3-methyl-benzenesulfonic acid
- Benzenesulfonic acid, 2(or 4)-hydroxy-3-methyl-
- Benzenesulfonic acid, 2-hydroxy-3-methyl-
- 2-hydroxy-3-methylbenzenesulfonic acid
- DTXSID6068729
- 00J85O58VS
- NS00010490
- AKOS015897637
- M-TOLUENESULFONIC ACID, 2-HYDROXY-
- o-Cresol-6-sulfonic acid
- UNII-00J85O58VS
- EINECS 223-670-8
- 52277-26-6
- 2-Hydroxy-3-methylbenzenesulphonic acid
- o-Cresol-4(or 6)-sulfonic acid
- Q27231354
- SCHEMBL21084
- 4016-01-7
-
- Inchi： 1S/C7H8O4S/c1-5-3-2-4-6(7(5)8)12(9,10)11/h2-4,8H,1H3,(H,9,10,11)
- InChI Key： ODEFERITUOZPHJ-UHFFFAOYSA-N
- SMILES： S(C1C=CC=C(C)C=1O)(=O)(=O)O
Computed Properties
- Exact Mass: 188.014
- Monoisotopic Mass: 188.014
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 241
- 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
- Topological Polar Surface Area: 83A^2
- XLogP3: 1.2
Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl- Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
52277-26-6 (Benzenesulfonic acid,2(or 4)-hydroxy-3-methyl-) Related Products
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