Ethyl 4-nitrophenyl decylphosphonate
Basic information
- CAS
10368-20-4- Standard SMILES
CCCCCCCCCCP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1- InChIKey
QAZQTRDRKXPDMA-UHFFFAOYSA-N- Molecular formula
- C18H30NO5P
- Average molar mass
- 371.4 g/mol
- Monoisotopic mass
- 371.18616006
Names & identifiers
- Preferred name
- Ethyl 4-nitrophenyl decylphosphonate
- IUPAC
- 1-[decyl(ethoxy)phosphoryl]oxy-4-nitrobenzene
Names & synonyms
ethyl 4-nitrophenyl decylphosphonate10368-20-4DTXSID00908552RefChem:1084954DTXCID901337631p-Nitrophenyl ethyl decylphosphonatePhosphonic acid, decyl-, ethyl p-nitrophenyl ester
Database identifiers
- CAS
10368-20-4- PubChem CID
- 82589
- DTXSID
DTXSID00908552- Nikkaji
- J50.282K
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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