Cas no 78749-58-3 (Benzenethiol, 4-amino-,hydrochloride (1:1))
78749-58-3 structure
Product Name:Benzenethiol, 4-amino-,hydrochloride (1:1)
CAS No:78749-58-3
MF:C6H8ClNS
MW:161.652419090271
CID:571237
PubChem ID:5743662
Update Time:2025-04-19
Benzenethiol, 4-amino-,hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenethiol, 4-amino-,hydrochloride (1:1)
- (4-sulfanylphenyl)azanium,chloride
- p-mercaptoanilinium chloride
- 4-sulfanylanilinium chloride
- 78749-58-3
- NS00090590
- EINECS 278-980-6
-
- Inchi： 1S/C6H7NS.ClH/c7-5-1-3-6(8)4-2-5;/h1-4,8H,7H2;1H
- InChI Key： QRVOMXNKYSBJSD-UHFFFAOYSA-N
- SMILES： [Cl-].SC1C=CC(=CC=1)[NH3+]
Computed Properties
- Exact Mass: 161.006598
- Monoisotopic Mass: 161.006598
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 66.9
- 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: 28.6
Experimental Properties
- Boiling Point: 262.3°C at 760 mmHg
- Flash Point: 112.4°C
Benzenethiol, 4-amino-,hydrochloride (1:1) Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
78749-58-3 (Benzenethiol, 4-amino-,hydrochloride (1:1)) Related Products
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