Cas no 71501-37-6 (Benzenesulfonic acid,3-amino-2-chloro-)
71501-37-6 structure
Product Name:Benzenesulfonic acid,3-amino-2-chloro-
CAS No:71501-37-6
MF:C6H6ClNO3S
MW:207.634739398956
CID:569090
PubChem ID:3018165
Update Time:2025-04-19
Benzenesulfonic acid,3-amino-2-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,3-amino-2-chloro-
- 3-amino-2-chlorobenzenesulfonic acid
- 3-amino-2-chlorobenzenesulphonic acid
- 3-Amino-2-chlorobenzene-1-sulfonic acid
- DTXSID10991970
- NS00062630
- 71501-37-6
- EINECS 275-565-1
- SCHEMBL2296085
-
- Inchi： 1S/C6H6ClNO3S/c7-6-4(8)2-1-3-5(6)12(9,10)11/h1-3H,8H2,(H,9,10,11)
- InChI Key： IUYPGBXHRROEGG-UHFFFAOYSA-N
- SMILES： ClC1C(=CC=CC=1S(=O)(=O)O)N
Computed Properties
- Exact Mass: 206.97578
- Monoisotopic Mass: 206.9756919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 248
- 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: 0.6
- Topological Polar Surface Area: 88.8?2
Experimental Properties
- Density: 1.642
- Refractive Index: 1.639
- PSA: 80.39
Benzenesulfonic acid,3-amino-2-chloro- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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