4-Nitro-o-phenylenediamine - CAS 99-56-9
Catalog: |
BB042309 |
Product Name: |
4-Nitro-o-phenylenediamine |
CAS: |
99-56-9 |
Synonyms: |
4-nitrobenzene-1,2-diamine |
IUPAC Name: | 4-nitrobenzene-1,2-diamine |
Description: | 4-Nitro-o-phenylenediamine (CAS# 99-56-9 ) is a useful research chemical. |
Molecular Weight: | 153.14 |
Molecular Formula: | C6H7N3O2 |
Canonical SMILES: | C1=CC(=C(C=C1[N+](=O)[O-])N)N |
InChI: | InChI=1S/C6H7N3O2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H,7-8H2 |
InChI Key: | RAUWPNXIALNKQM-UHFFFAOYSA-N |
Boiling Point: | 421.1 °C at 760 mmHg |
Melting Point: | 196-201 °C |
Purity: | 95 % |
Density: | 1.446 g/cm3 |
Appearance: | Orange-red powder |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00007724 |
LogP: | 2.44480 |
Vapor Pressure: | 0.000109 [mmHg] |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
26198647 | 20150817 | Oxidative Stress Mechanisms Do Not Discriminate between Genotoxic and Nongenotoxic Liver Carcinogens | Chemical research in toxicology |
22129271 | 20120601 | Protective effect of Enicostema axillare on mutagenicity of Salmonella typhimurium by increasing free radical scavenging abilities | Pharmaceutical biology |
22490278 | 20120410 | Polar extracts from (Tunisian) Acacia salicina Lindl. Study of the antimicrobial and antigenotoxic activities | BMC complementary and alternative medicine |
22589761 | 20120401 | catena-Poly[[[aqua-manganese(III)]-μ-(E)-5-bromo-N-[2-(5-bromo-2-oxidobenzyl-idene-amino)-4-nitro-phen-yl]-2-oxidobenzamidato] N,N-dimethyl-fomamide monosolvate] | Acta crystallographica. Section E, Structure reports online |
22394515 | 20120328 | Development and validation of a high-performance liquid chromatography method for the determination of diacetyl in beer using 4-nitro-o-phenylenediamine as the derivatization reagent | Journal of agricultural and food chemistry |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.053826475 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.053826475 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 97.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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