1-(2-Methyl-2-nitropropyl)-4-nitrobenzene
Basic information
- CAS
5440-67-5- Standard SMILES
CC(C)(Cc1ccc([N+](=O)[O-])cc1)[N+](=O)[O-]- InChIKey
RYQDSPKQTUQTND-UHFFFAOYSA-N- Molecular formula
- C10H12N2O4
- Average molar mass
- 224.21 g/mol
- Monoisotopic mass
- 224.07970687
Names & identifiers
- Preferred name
- 1-(2-Methyl-2-nitropropyl)-4-nitrobenzene
- IUPAC
- 1-(2-methyl-2-nitropropyl)-4-nitrobenzene
- English name
- 1-(2-methyl-2-nitro-propyl)-4-nitro-benzene
- Molecular formula
- C10H12N2O4
- Molecular weight
- 224.21
Names & synonyms
1-(2-methyl-2-nitropropyl)-4-nitrobenzene5440-67-5DTXSID80281193RefChem:223698DTXCID802323471-(2-METHYL-2-NITRO-PROPYL)-4-NITRO-BENZENENSC20701SCHEMBL97944RYQDSPKQTUQTND-UHFFFAOYSA-N2-Nitro-2-(4-nitrobenzyl)propaneNSC-20701NSC126456
Show more names
Benzene, 1-(2-methyl-2-nitropropyl)-4-nitro-
AKOS024332420NSC-1264562-(4-nitrophenyl)-1,1-dimethyl-1-nitroethane
Database identifiers
- CAS
5440-67-5- PubChem CID
- 228091
- DTXSID
DTXSID80281193- Nikkaji
- J1.108.552K
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 272
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Related reactions
2 records
Compound notes
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