2-Amino-5-nitrobenzimidazole - CAS 6232-92-4
Catalog: |
BB031536 |
Product Name: |
2-Amino-5-nitrobenzimidazole |
CAS: |
6232-92-4 |
Synonyms: |
6-nitro-1H-benzimidazol-2-amine; 6-nitro-1H-benzimidazol-2-amine |
IUPAC Name: | 6-nitro-1H-benzimidazol-2-amine |
Description: | 2-Amino-5-nitrobenzimidazole (CAS# 6232-92-4) is a useful research chemical. |
Molecular Weight: | 178.15 |
Molecular Formula: | C7H6N4O2 |
Canonical SMILES: | C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)N |
InChI: | InChI=1S/C7H6N4O2/c8-7-9-5-2-1-4(11(12)13)3-6(5)10-7/h1-3H,(H3,8,9,10) |
InChI Key: | HSEDDANFWUMVCY-UHFFFAOYSA-N |
Boiling Point: | 478.5 °C at 760 mmHg |
Density: | 1.631 g/cm3 |
Appearance: | Solid |
LogP: | 2.15770 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020079184-A2 | Urea derivatives for treating and/or preventing cancer | 20181017 |
EP-3866791-A2 | Urea derivatives for treating and/or preventing cancer | 20181017 |
KR-20210100604-A | Urea derivatives for the treatment and/or prophylaxis of cancer | 20181017 |
WO-2017153952-A1 | 5-sulfamoyl-2-hydroxybenzamide derivatives | 20160310 |
CN-105384693-A | Compound containing benzoxazole ring bis(azo) structure, synthetic method for compound and use of compound | 20151021 |
PMID | Publication Date | Title | Journal |
21583609 | 20090718 | 2-Amino-6-nitro-1H-benzoimidazol-3-ium chloride | Acta crystallographica. Section E, Structure reports online |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.04907545 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.04907545 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 101 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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