2-Methyl-6-nitro-1H-benzimidazol-4-ol
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Basic information
- CAS
64236-07-3- Standard SMILES
Cc1nc2c(O)cc([N+](=O)[O-])cc2[nH]1- InChIKey
KCZGMBORWYLZKH-UHFFFAOYSA-N- Molecular formula
- C8H7N3O3
- Average molar mass
- 193.16 g/mol
- Monoisotopic mass
- 193.04874109
Names & identifiers
- Preferred name
- 2-Methyl-6-nitro-1H-benzimidazol-4-ol
- IUPAC
- 2-methyl-6-nitro-1H-benzimidazol-4-ol
- English name
- 1H-Benzimidazol-4-ol,2-methyl-6-nitro-(9CI)
- Molecular formula
- C8H7N3O3
- Molecular weight
- 193.16
Names & synonyms
64236-07-31H-Benzimidazol-4-ol, 2-methyl-6-nitro-2-Methyl-6-nitro-1H-benzimidazol-4-olSCHEMBL7029112SCHEMBL7029119DTXSID102144342-Methyl-6-nitro-1H-1,3-benzimidazol-4-ol1H-Benzimidazol-7-ol, 2-methyl-5-nitro-1H-Benzimidazol-4-ol,2-methyl-6-nitro-(9CI)
Database identifiers
- CAS
64236-07-3- PubChem CID
- 5488252
- DTXSID
DTXSID10214434
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 94.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
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Compound notes
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