Cas no 117998-06-8 (Benzenesulfonic acid,4-amino-, lithium salt (1:1))
117998-06-8 structure
Product Name:Benzenesulfonic acid,4-amino-, lithium salt (1:1)
CAS No:117998-06-8
MF:C6H6LiNO3S
MW:179.122740268707
CID:232525
PubChem ID:44149263
Update Time:2025-04-19
Benzenesulfonic acid,4-amino-, lithium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,4-amino-, lithium salt (1:1)
- lithium,4-aminobenzenesulfonate
- LogP
- Benzenesulfonic acid, 4-amino-, lithium salt (1:1)
- sulfanilate lithium salt
- Benzenesulfonic acid, 4-amino-, monolithium salt
- DTXSID1073074
- ZBAFARDUZOEUPJ-UHFFFAOYSA-M
- 117998-06-8
-
- Inchi： 1S/C6H7NO3S.Li/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4H,7H2,(H,8,9,10);/q;+1/p-1
- InChI Key： ZBAFARDUZOEUPJ-UHFFFAOYSA-M
- SMILES： S(C1C=CC(=CC=1)N)(=O)(=O)[O-].[Li+]
Computed Properties
- Exact Mass: 178.022
- Monoisotopic Mass: 179.02284266g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 215
- 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: 91.6?2
Experimental Properties
- PSA: 83.22
Benzenesulfonic acid,4-amino-, lithium salt (1:1) Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
117998-06-8 (Benzenesulfonic acid,4-amino-, lithium salt (1:1)) Related Products
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- 86-60-2(1-Naphthalenesulfonicacid, 7-amino-)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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