Cas no 20614-71-5 (Benzothiazole,2-pentyl-)
Benzothiazole,2-pentyl- structure
Product Name:Benzothiazole,2-pentyl-
CAS No:20614-71-5
MF:C12H15NS
MW:205.31920170784
CID:241357
PubChem ID:12406333
Update Time:2025-04-19
Benzothiazole,2-pentyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole,2-pentyl-
- 2-(1-Pentyl)benzothiazole
- 2-(pentan-2-yl)benzo[d]thiazole
- 20614-71-5
- 2-Pentyl-1,3-benzothiazole
- SCHEMBL175532
- FT-0723510
-
- Inchi： 1S/C12H15NS/c1-2-3-4-9-12-13-10-7-5-6-8-11(10)14-12/h5-8H,2-4,9H2,1H3
- InChI Key： HEDKBCKXJGJZQH-UHFFFAOYSA-N
- SMILES： S1C2C=CC=CC=2N=C1CCCCC
Computed Properties
- Exact Mass: 205.09265
- Monoisotopic Mass: 205.09252066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 172
- 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: 4.9
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 12.89
Benzothiazole,2-pentyl- Related Literature
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
20614-71-5 (Benzothiazole,2-pentyl-) Related Products
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