Cas no 2784-93-2 (1,4-Benzenediamine, N,N'-dimethyl-2-nitro-)
2784-93-2 structure
Product Name:1,4-Benzenediamine, N,N'-dimethyl-2-nitro-
CAS No:2784-93-2
MF:C8H11N3O2
MW:181.191841363907
CID:237743
PubChem ID:12454259
Update Time:2025-04-19
1,4-Benzenediamine, N,N'-dimethyl-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine, N,N'-dimethyl-2-nitro-
- 1-N,4-N-dimethyl-2-nitrobenzene-1,4-diamine
- 2784-93-2
- N~1~,N~4~-Dimethyl-2-nitrobenzene-1,4-diamine
- DTXSID60498944
- SCHEMBL10534498
-
- Inchi： 1S/C8H11N3O2/c1-9-6-3-4-7(10-2)8(5-6)11(12)13/h3-5,9-10H,1-2H3
- InChI Key： MYOOTZAUHFEBBL-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=CC=1NC)NC)=O
Computed Properties
- Exact Mass: 181.085126602g/mol
- Monoisotopic Mass: 181.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 181
- 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: 2.4
- Topological Polar Surface Area: 69.9?2
1,4-Benzenediamine, N,N'-dimethyl-2-nitro- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
2784-93-2 (1,4-Benzenediamine, N,N'-dimethyl-2-nitro-) Related Products
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