Cas no 568577-85-5 (5-METHYL-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE)
568577-85-5 structure
Product Name:5-METHYL-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE
CAS No:568577-85-5
MF:C10H7ClOS
MW:210.679980516434
CID:841339
PubChem ID:2794644
Update Time:2025-04-19
5-METHYL-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE Chemical and Physical Properties
Names and Identifiers
-
- 5-METHYL-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE
- 5-METHYL-BENZO[B]THIOPHENE-2-CARBONYL CHLORIDE
- AC1MDRKH
- AG-G-00026
- CTK5A5807
- KB-197972
- SBB031623
-
- MDL： MFCD04968793
- Inchi： 1S/C10H7ClOS/c1-6-2-3-8-7(4-6)5-9(13-8)10(11)12/h2-5H,1H3
- InChI Key： RSDZRBLRCRNYRU-UHFFFAOYSA-N
- SMILES： ClC(C1=CC2C=C(C)C=CC=2S1)=O
Computed Properties
- Exact Mass: 209.99100
- Monoisotopic Mass: 209.9906137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 219
- 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: 4.1
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 45.31000
- LogP: 3.58870
5-METHYL-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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