Cas no 92847-39-7 ( )
structure
Product Name:
CAS No:92847-39-7
MF:C11H10ClNO2S
MW:255.720600605011
CID:867827
PubChem ID:21409037
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-4-(3,4-dimethoxyphenyl)-1,3-thiazole
- 2-CHLORO-4-(3,4-DIMETHOXYPHENYL)THIAZOLE
- DTXSID70613287
- 92847-39-7
- AKOS002657940
-
-
- Inchi： 1S/C11H10ClNO2S/c1-14-9-4-3-7(5-10(9)15-2)8-6-16-11(12)13-8/h3-6H,1-2H3
- InChI Key： IUNIWEVFBFMCPW-UHFFFAOYSA-N
- SMILES： ClC1=NC(=CS1)C1=CC=C(C(=C1)OC)OC
Computed Properties
- Exact Mass: 255.012
- Monoisotopic Mass: 255.012
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 232
- 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
- Topological Polar Surface Area: 59.6A^2
- XLogP3: 3.5
Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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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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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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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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