Cas no 90405-67-7 (N,n-dimethyl-2-(4-nitrophenyl)acetamide)
90405-67-7 structure
Product Name:N,n-dimethyl-2-(4-nitrophenyl)acetamide
CAS No:90405-67-7
MF:C10H12N2O3
MW:208.213882446289
CID:1950685
Update Time:2023-03-23
N,n-dimethyl-2-(4-nitrophenyl)acetamide Chemical and Physical Properties
Names and Identifiers
-
- N,n-dimethyl-2-(4-nitrophenyl)acetamide
- CTK5G7816
- ARONIS023788
- AC1L6MSK
- (4-Nitro-phenyl)-essigsaeure-dimethylamid
- N,N-dimethyl-4-nitrobenzeneacetamide
- NSC66038
- STL071233
- SureCN3804808
- ARONIS23974
- (4-nitro-phenyl)-acetic acid dimethylamide
- Benzeneacetamide, N,N-dimethyl-4-nitro-
-
- Inchi： 1S/C10H12N2O3/c1-11(2)10(13)7-8-3-5-9(6-4-8)12(14)15/h3-6H,7H2,1-2H3
- InChI Key： UCQWVIYMRZFMBM-UHFFFAOYSA-N
- SMILES： C1(CC(N(C)C)=O)=CC=C([N+]([O-])=O)C=C1
Computed Properties
- Exact Mass: 208.084792
- Monoisotopic Mass: 208.084792
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 240
- 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: 1.3
- Topological Polar Surface Area: 66.1
Experimental Properties
- Density: 1.214
- Boiling Point: 376°C at 760 mmHg
- Flash Point: 181.2°C
- Refractive Index: 1.558
N,n-dimethyl-2-(4-nitrophenyl)acetamide Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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