Phosphonic acid, phenyl-, dipropyl ester
Basic information
- CAS
20677-03-6- Standard SMILES
CCCOP(=O)(OCCC)c1ccccc1- InChIKey
PXGLYSITKOROKV-UHFFFAOYSA-N- Molecular formula
- C12H19O3P
- Average molar mass
- 242.25 g/mol
- Monoisotopic mass
- 242.10718146
Names & identifiers
- Preferred name
- Phosphonic acid, phenyl-, dipropyl ester
- IUPAC
- dipropoxyphosphorylbenzene
Names & synonyms
Phosphonic acid, phenyl-, dipropyl ester20677-03-6DTXSID30471406RefChem:370594DTXCID40422222dipropyl phenylphosphonateSCHEMBL500627SCHEMBL6894150
Database identifiers
- CAS
20677-03-6- PubChem CID
- 11736632
- DTXSID
DTXSID30471406- Nikkaji
- J1.673.544B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 212
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Compound notes
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