Cas no 62803-08-1 (Acetamide, 2,2,2-trichloro-N-(iminomethyl)-)
62803-08-1 structure
Product Name:Acetamide, 2,2,2-trichloro-N-(iminomethyl)-
CAS No:62803-08-1
MF:C3H3Cl3N2O
MW:189.427717447281
CID:430991
PubChem ID:53804478
Update Time:2025-04-19
Acetamide, 2,2,2-trichloro-N-(iminomethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, 2,2,2-trichloro-N-(iminomethyl)-
- N-(aminomethylidene)-2,2,2-trichloroacetamide
- N-[(E)-Aminomethylidene]-2,2,2-trichloroacetamide
- 62803-08-1
- DTXSID70706789
-
- Inchi： 1S/C3H3Cl3N2O/c4-3(5,6)2(9)8-1-7/h1H,(H2,7,8,9)
- InChI Key： FKRUPSIBHRTNHF-UHFFFAOYSA-N
- SMILES： ClC(C(/N=C/N)=O)(Cl)Cl
Computed Properties
- Exact Mass: 187.93129
- Monoisotopic Mass: 187.931
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 139
- 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: 1.6
- Topological Polar Surface Area: 55.4?2
Experimental Properties
- PSA: 52.95
Acetamide, 2,2,2-trichloro-N-(iminomethyl)- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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