Cas no 4845-64-1 (Naphtho[1,2-d]thiazole-2(1H)-thione)
![Naphtho[1,2-d]thiazole-2(1H)-thione structure](https://ossimg.kuujia.com/scimg/5000/4845-64-1x500.png)
4845-64-1 structure
Product Name:Naphtho[1,2-d]thiazole-2(1H)-thione
Naphtho[1,2-d]thiazole-2(1H)-thione Chemical and Physical Properties
Names and Identifiers
-
- Naphtho[1,2-d]thiazole-2(1H)-thione
- 1H-benzo[e][1,3]benzothiazole-2-thione
- 2-MERCAPTO-NAPHTH[1,2-D]THIAZOLE
- 1H-Naphtho[1,2-d]thiazol-2-thion
- 1H-naphtho[1,2-d]thiazole-2-thione
- 2-Mercaptonaphthol(1,2-d)thiazole
- Naphtho(1,2-d)thiazole-2(1H)-thione
- DTXSID8063622
- 4845-64-1
- SCHEMBL2211087
- AKOS015963285
-
- Inchi： 1S/C11H7NS2/c13-11-12-10-8-4-2-1-3-7(8)5-6-9(10)14-11/h1-6H,(H,12,13)
- InChI Key： MRORKWHSOOKUDV-UHFFFAOYSA-N
- SMILES： S1C(NC2=C1C=CC1C=CC=CC2=1)=S
Computed Properties
- Exact Mass: 217.00200
- Monoisotopic Mass: 217.002
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 254
- 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: 3.5
- Topological Polar Surface Area: 69.4?2
Experimental Properties
- Density: 1.46
- Boiling Point: 413.7°Cat760mmHg
- Flash Point: 204°C
- Refractive Index: 1.838
- PSA: 79.93000
- LogP: 3.73820
Naphtho[1,2-d]thiazole-2(1H)-thione Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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