Cas no 118220-72-7 (Benzothiazole, 6-ethyl-)
Benzothiazole, 6-ethyl- structure
Product Name:Benzothiazole, 6-ethyl-
CAS No:118220-72-7
MF:C9H9NS
MW:163.239460706711
CID:131799
PubChem ID:17918147
Update Time:2025-04-19
Benzothiazole, 6-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole, 6-ethyl-
- 6-ethyl-1,3-benzothiazole
- Benzothiazole, 6-ethyl- (9CI)
- 6-Ethylbenzo[d]thiazole, 97%
- Benzothiazole,6-ethyl-(9ci)
- SCHEMBL763958
- DTXSID60591601
- 118220-72-7
-
- Inchi： 1S/C9H9NS/c1-2-7-3-4-8-9(5-7)11-6-10-8/h3-6H,2H2,1H3
- InChI Key： CQGBKJUMTILWPU-UHFFFAOYSA-N
- SMILES： S1C=NC2=CC=C(C=C12)CC
Computed Properties
- Exact Mass: 163.04567
- Monoisotopic Mass: 163.04557046g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 138
- 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: 2.8
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 12.89
Benzothiazole, 6-ethyl- Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
118220-72-7 (Benzothiazole, 6-ethyl-) Related Products
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