2-Amino-6-(1-methylpropyl)-4-nitrophenol
Basic information
- CAS
29709-87-3- Standard SMILES
CCC(C)c1cc([N+](=O)[O-])cc(N)c1O- InChIKey
CIMKCSKJNMVQAL-UHFFFAOYSA-N- Molecular formula
- C10H14N2O3
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.10044231
Names & identifiers
- Preferred name
- 2-Amino-6-(1-methylpropyl)-4-nitrophenol
- IUPAC
- 2-amino-6-butan-2-yl-4-nitrophenol
- English name
- 2-amino-6-butan-2-yl-4-nitro-phenol
- Molecular formula
- C10H14N2O3
- Molecular weight
- 0
Names & synonyms
29709-87-32-Amino-6-(1-methylpropyl)-4-nitrophenolPhenol, 2-amino-6-(1-methylpropyl)-4-nitro-2-amino-6-butan-2-yl-4-nitrophenolSCHEMBL7686338DTXSID509521612-s-butyl-4-nitro-6-aminophenol2-Amino-6-(butan-2-yl)-4-nitrophenol2-amino-6-butan-2-yl-4-nitro-phenol
Database identifiers
- CAS
29709-87-3- PubChem CID
- 5743418
- DTXSID
DTXSID50952161
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 92.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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