Cas no 85135-99-5 (Sodium 2,6-diaminotoluene-3-sulphonate)
85135-99-5 structure
Product Name:Sodium 2,6-diaminotoluene-3-sulphonate
CAS No:85135-99-5
MF:C7H9N2NaO3S
MW:224.212731122971
CID:887437
Update Time:2023-08-03
Sodium 2,6-diaminotoluene-3-sulphonate Chemical and Physical Properties
Names and Identifiers
-
- sodium 2,6-diaminotoluene-3-sulphonate
- sodium,2,4-diamino-3-methylbenzenesulfonate
- SODIUM 2,6-DIAMINOTOLUENE-3-SULFONATE
- 2,4-Diamino-3-methylbenzenesulfonic acid sodium salt
- Sodium 2,6-diaminotoluene-3-sulphonate
-
- Inchi: 1S/C7H10N2O3S.Na/c1-4-5(8)2-3-6(7(4)9)13(10,11)12;/h2-3H,8-9H2,1H3,(H,10,11,12);/q;+1/p-1
- InChI Key: BBGQOMSAZOPRBP-UHFFFAOYSA-M
- SMILES: S(C1C=CC(=C(C)C=1N)N)(=O)(=O)[O-].[Na+]
Computed Properties
- Exact Mass: 224.023158
- Monoisotopic Mass: 224.023158
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 277
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 118
Sodium 2,6-diaminotoluene-3-sulphonate Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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