Phosphonic acid, ethyl-, isopropyl p-nitrophenyl ester
Basic information
- CAS
7284-58-4- Standard SMILES
CCP(=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C- InChIKey
SKCQHKZCRLKONK-UHFFFAOYSA-N- Molecular formula
- C11H16NO5P
- Average molar mass
- 273.22 g/mol
- Monoisotopic mass
- 273.07660961
Names & identifiers
- Preferred name
- Phosphonic acid, ethyl-, isopropyl p-nitrophenyl ester
- IUPAC
- 1-[ethyl(propan-2-yloxy)phosphoryl]oxy-4-nitrobenzene
- English name
- Ethylphosphonic acid isopropyl 4-nitrophenyl ester
- Molecular weight
- 0
Names & synonyms
7284-58-4Phosphonic acid, ethyl-, isopropyl p-nitrophenyl esterRefChem:10951744-nitrophenyl propan-2-yl ethylphosphonateIsopropyl p-nitrophenyl ethylphosphonateBRN 2143214DTXSID50993635SKCQHKZCRLKONK-UHFFFAOYSA-NEthylphosphonic acid isopropyl p-nitrophenyl esterEthylphosphonic acid isopropyl 4-nitrophenyl ester
Database identifiers
- CAS
7284-58-4- PubChem CID
- 81701
- DTXSID
DTXSID50993635- Nikkaji
- J50.287A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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