Cas no 7461-99-6 (N-(methylideneamino)-4-nitrobenzamide)
7461-99-6 structure
Product Name:N-(methylideneamino)-4-nitrobenzamide
CAS No:7461-99-6
MF:C8H7N3O3
MW:193.159481287003
CID:979494
PubChem ID:346096
Update Time:2025-04-19
N-(methylideneamino)-4-nitrobenzamide Chemical and Physical Properties
Names and Identifiers
-
- N-(methylideneamino)-4-nitrobenzamide
- 4-Nitro-benzoesaeure-methylenhydrazid
- 4-nitro-benzoic acid methylenehydrazide
- AC1L847Q
- NSC404136
- NSC-404136
- N'-Methylidene-4-nitrobenzohydrazide
- 7461-99-6
- DTXSID20323501
-
- Inchi： 1S/C8H7N3O3/c1-9-10-8(12)6-2-4-7(5-3-6)11(13)14/h2-5H,1H2,(H,10,12)
- InChI Key： IWSSSUFJBOVDGO-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(=CC=1)[N+](=O)[O-])NN=C
Computed Properties
- Exact Mass: 193.04881
- Monoisotopic Mass: 193.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 241
- 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: 2.6
- Topological Polar Surface Area: 87.3?2
Experimental Properties
- Density: 1.34
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.6
- PSA: 84.6
- LogP: 1.85430
N-(methylideneamino)-4-nitrobenzamide Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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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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