Basic information
- CAS
63906-99-0- Standard SMILES
CCCCCCC(O)C(C)(Cl)[N+](=O)[O-]- InChIKey
TVJDCJVCGXSILJ-UHFFFAOYSA-N- Molecular formula
- C9H18ClNO3
- Average molar mass
- 223.7 g/mol
- Monoisotopic mass
- 223.0975211
Names & identifiers
- Preferred name
- 2-Chloro-2-nitrononan-3-ol
- IUPAC
- 2-chloro-2-nitrononan-3-ol
- English name
- 2-Chloro-2-nitro-3-nonanol
- Molecular formula
- C9H18ClNO3
- Molecular weight
- 223.7
Names & synonyms
2-chloro-2-nitrononan-3-ol63906-99-0DTXSID60980950RefChem:1062744DTXCID4014082232-Chloro-2-nitro-3-nonanolUSAF CS-12953-NONANOL, 2-CHLORO-2-NITRO-DB-302933
Database identifiers
- CAS
63906-99-0- PubChem CID
- 45183
- DTXSID
DTXSID60980950- Nikkaji
- J64.703I
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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