1,4-Benzenediamine, 2,3-dimethyl-5-nitro-

Base Information

• Chemical Name: 1,4-Benzenediamine, 2,3-dimethyl-5-nitro-
• CAS No.: 97629-28-2
• Molecular Formula: C8H11 N3 O2
• Molecular Weight: 181.22
• UNII: 9E5L7NQ95B
• DSSTox Substance ID: DTXSID10243067
• Nikkaji Number: J579.790J
• Wikidata: Q83127043
• Mol file: 97629-28-2.mol

Synonyms:4-Amino-3-nitro-5,6-dimethylaniline;1,4-Benzenediamine, 2,3-dimethyl-5-nitro-;2,3-Dimethyl-5-nitro-1,4-benzenediamine;97629-28-2;9E5L7NQ95B;CCRIS 8129;2,3-dimethyl-5-nitrobenzene-1,4-diamine;UNII-9E5L7NQ95B;SCHEMBL9107921;DTXSID10243067;AKOS006276249;LS-29603;5-Nitro-2,3-dimethyl-1,4-benzenediamine;AMINO-3-NITRO-5,6-DIMETHYLANILINE, 4-

Chemical Property of 1,4-Benzenediamine, 2,3-dimethyl-5-nitro-

Chemical Property:

• Vapor Pressure: 5.34E-07mmHg at 25°C
• Refractive Index: 1.7400 (estimate)
• Boiling Point: 412°Cat760mmHg
• Flash Point: 203°C
• PSA: 97.86000
• Density: 1.309g/cm³
• LogP: 3.06160
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 181.085126602
• Heavy Atom Count: 13
• Complexity: 204

Purity/Quality:

99% ^*data from raw suppliers

1,4-BENZENEDIAMINE, 2,3-DIMETHYL-5-NITRO- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C=C1N)[N+](=O)[O-])N)C

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