Basic information
- CAS
33973-56-7- Standard SMILES
CCCCC(c1ccccc1)P(=O)(OCC)OCC- InChIKey
YXYYZPDGOACFLV-UHFFFAOYSA-N- Molecular formula
- C15H25O3P
- Average molar mass
- 284.33 g/mol
- Monoisotopic mass
- 284.15413165
Names & identifiers
- Preferred name
- Phosphonic acid, (alpha-butylbenzyl)-, diethyl ester
- IUPAC
- 1-diethoxyphosphorylpentylbenzene
- English name
- (1-Phenylpentyl)phosphonic acid diethyl ester
- Molecular formula
- C15H25O3P
- Molecular weight
- 284.33
Names & synonyms
Phosphonic acid, (alpha-butylbenzyl)-, diethyl esterRefChem:1095158Diethyl 1-phenylpentylphosphonate33973-56-7Diethyl (1-phenylpentyl)phosphonatediethyl(1-phenylpentyl)phosphonateDiethyl (alpha-butylbenzyl)phosphonateNSC 220103BRN 2944423Phosphonic acid, (1-phenylpentyl)-, diethyl ester(1-Phenylpentyl)phosphonic acid diethyl esterWLN: 4YR&PO&O2&O2
Show more names
Phosphonic acid, P-(1-phenylpentyl)-, diethyl ester
NSC220103NSC-220103Diethyl (.alpha.-butylbenzyl)phosphonate
Database identifiers
- CAS
33973-56-7- PubChem CID
- 99790
- Nikkaji
- J50.275H
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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