Cas no 88-52-8 (Benzenesulfonic acid,2,4-diamino-5-methyl-)
88-52-8 structure
Product Name:Benzenesulfonic acid,2,4-diamino-5-methyl-
Benzenesulfonic acid,2,4-diamino-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,2,4-diamino-5-methyl-
- 2,4-Diamino-5-methylbenzenesulfonic acid
- 4,6-diaminotoluene-3-sulphonic acid
- DTXSID1058971
- 2,4-Diaminotoluene-5-sulfonic acid
- 88-52-8
- 4,6-Diaminotoluene-3-sulfonic acid
- Benzenesulfonic acid, 2,4-diamino-5-methyl-
- EINECS 201-838-1
- SCHEMBL428347
- Benzenesulfonic acid,4-diamino-5-methyl-
- NS00039277
- m-Toluenesulfonic acid, 4,6-diamino-
- 2,4-Tolylenediamine-5-sulfonic acid
- NSC 8621
- m-Toluenesulfonic acid,6-diamino-
- NSC-8621
- NSC8621
- 5-Methyl-2,4-diaminobenzenesulfonic acid
-
- Inchi： 1S/C7H10N2O3S/c1-4-2-7(13(10,11)12)6(9)3-5(4)8/h2-3H,8-9H2,1H3,(H,10,11,12)
- InChI Key： XAQCYASNAMYTQA-UHFFFAOYSA-N
- SMILES： S(C1C=C(C)C(=CC=1N)N)(=O)(=O)O
Computed Properties
- Exact Mass: 202.041213
- Monoisotopic Mass: 202.041213
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 272
- 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: 115
- XLogP3: 0.2
Experimental Properties
- Density: 1.52
- Refractive Index: 1.657
- PSA: 114.79000
- LogP: 2.64930
Benzenesulfonic acid,2,4-diamino-5-methyl- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
88-52-8 (Benzenesulfonic acid,2,4-diamino-5-methyl-) Related Products
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