Cas no 80661-10-5 (Acetamide, 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]-)
80661-10-5 structure
Product Name:Acetamide, 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]-
CAS No:80661-10-5
MF:C10H8Cl2F3NO
MW:286.077831268311
CID:705249
PubChem ID:13391403
Update Time:2025-04-19
Acetamide, 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
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- Acetamide, 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]-
- 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]acetamide
- DTXSID90539137
- 80661-10-5
- SCHEMBL10797916
- 2'-(chloromethyl)-6'-(trifluoromethyl)-2-chloroacetanilide
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- Inchi: 1S/C10H8Cl2F3NO/c11-4-6-2-1-3-7(10(13,14)15)9(6)16-8(17)5-12/h1-3H,4-5H2,(H,16,17)
- InChI Key: BWJUXYVLCVTNNT-UHFFFAOYSA-N
- SMILES: ClCC1=CC=CC(C(F)(F)F)=C1NC(CCl)=O
Computed Properties
- Exact Mass: 284.9935038g/mol
- Monoisotopic Mass: 284.9935038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 273
- 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
- Topological Polar Surface Area: 29.1?2
Acetamide, 2-chloro-N-[2-(chloromethyl)-6-(trifluoromethyl)phenyl]- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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