Cas no 56896-76-5 (2-Benzothiazolamine,6-methyl-, hydrochloride (1:1))
56896-76-5 structure
Product Name:2-Benzothiazolamine,6-methyl-, hydrochloride (1:1)
CAS No:56896-76-5
MF:C8H9ClN2S
MW:200.688459157944
CID:376287
PubChem ID:3017053
Update Time:2025-04-19
2-Benzothiazolamine,6-methyl-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 2-Benzothiazolamine,6-methyl-, hydrochloride (1:1)
- 6-methyl-1,3-benzothiazol-2-amine,hydrochloride
- 6-methylbenzothiazol-2-amine monohydrochloride
- 6-Methylbenzothiazol-2-amine HCl
- DTXSID30205420
- 56896-76-5
- NS00087793
- EINECS 260-422-8
- 2-Benzothiazolamine, 6-methyl-, hydrochloride (1:1)
-
- Inchi： 1S/C8H8N2S.ClH/c1-5-2-3-6-7(4-5)11-8(9)10-6;/h2-4H,1H3,(H2,9,10);1H
- InChI Key： LSZDFOQRIMQFIV-UHFFFAOYSA-N
- SMILES： Cl.S1C(N)=NC2C=CC(C)=CC1=2
Computed Properties
- Exact Mass: 200.01767
- Monoisotopic Mass: 200.0174972g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 151
- 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: 67.2?2
Experimental Properties
- PSA: 38.91
2-Benzothiazolamine,6-methyl-, hydrochloride (1:1) Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
56896-76-5 (2-Benzothiazolamine,6-methyl-, hydrochloride (1:1)) Related Products
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