Cas no 155379-82-1 (1,4-Benzenediamine,2-methyl-6-nitro-)
155379-82-1 structure
Product Name:1,4-Benzenediamine,2-methyl-6-nitro-
CAS No:155379-82-1
MF:C7H9N3O2
MW:167.165261030197
CID:186001
PubChem ID:5488468
Update Time:2025-04-19
1,4-Benzenediamine,2-methyl-6-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine,2-methyl-6-nitro-
- 2-methyl-6-nitrobenzene-1,4-diamine
- 2-Methyl-6-nitro-1,4-benzenediamine
- 4-Amino-3-nitro-5-methylaniline
- CCRIS 8124
- AKOS006276252
- 155379-82-1
- 1,4-Benzenediamine, 2-methyl-6-nitro-
- SCHEMBL9107706
- DTXSID60165886
-
- Inchi： 1S/C7H9N3O2/c1-4-2-5(8)3-6(7(4)9)10(11)12/h2-3H,8-9H2,1H3
- InChI Key： WJADKDGCBYAUMT-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC(=CC(C)=C1N)N)=O
Computed Properties
- Exact Mass: 167.06957
- Monoisotopic Mass: 167.069477
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 180
- 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
- Topological Polar Surface Area: 97.9
- XLogP3: 1.3
Experimental Properties
- Density: 1.2998 (rough estimate)
- Boiling Point: 295.73°C (rough estimate)
- Flash Point: 189.8°C
- Refractive Index: 1.5860 (estimate)
- PSA: 95.18
1,4-Benzenediamine,2-methyl-6-nitro- Related Literature
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
155379-82-1 (1,4-Benzenediamine,2-methyl-6-nitro-) Related Products
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