Hexanoic acid, 4,6-dinitro-
Basic information
- CAS
144449-85-4- Standard SMILES
O=C(O)CCC(CC[N+](=O)[O-])[N+](=O)[O-]- InChIKey
AXBUOPOPPOABHG-UHFFFAOYSA-N- Molecular formula
- C6H10N2O6
- Average molar mass
- 206.15 g/mol
- Monoisotopic mass
- 206.05388604
Names & identifiers
- Preferred name
- Hexanoic acid, 4,6-dinitro-
- IUPAC
- 4,6-dinitrohexanoic acid
Names & synonyms
Hexanoic acid, 4,6-dinitro-144449-85-4DTXSID90429488RefChem:347694DTXCID703803214,6-Dinitrohexanoic acidSCHEMBL7574424
Database identifiers
- CAS
144449-85-4- PubChem CID
- 9543367
- DTXSID
DTXSID90429488
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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