[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene

C14H14FO3P — CID 14175848

IUPAC[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene
SMILESO=P(F)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C14H14FO3P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyJCKPZEIORHBOOG-UHFFFAOYSA-N
MW280.24 g/mol
LogP4.50
Rot. Bonds6

About [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene

[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene (PubChem CID 14175848) has the molecular formula C14H14FO3P and a molecular weight of 280.24 g/mol. Its IUPAC name is [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene.

Molecular Properties

Compound Name[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene
PubChem CID14175848
Molecular FormulaC14H14FO3P
Molecular Weight280.24 g/mol
Exact Mass280.07
IUPAC Name[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene
SMILESO=P(F)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C14H14FO3P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyJCKPZEIORHBOOG-UHFFFAOYSA-N
XLogP4.50
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.24
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

Dibenzyl phosphate
CID 74189
Tribenzyl phosphate
CID 74359
Benzyl diethyl phosphite
CID 76006
Diethyl 2,2,2-trifluoro-1-phenylethyl phosphate
CID 14026656
Benzyl diphenylphosphinate
CID 298803
2,2,3,3,4,4,4-Heptafluoro-1-phenylbutyl hydrogen phenylphosphonate
CID 2897885
Sulfurous acid, dibenzyl ester
CID 99368
Phosphinic acid, bis(hydroxyphenylmethyl)-
CID 120172
Tetrabenzyl pyrophosphate
CID 563183
Dibenzyl phosphite
CID 6334615
Dimethyl 2,2,2-trifluoro-1-phenylethyl phosphate
CID 11666354
Ethyl [(4-fluorophenyl)(hydroxy)methyl]phenylphosphinate
CID 2909852

Frequently Asked Questions

What is the IUPAC name of [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene?
The IUPAC name of [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene (CID 14175848) is [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene.
What is the SMILES notation for [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene?
The canonical SMILES for [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene is O=P(F)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene?
The InChIKey is JCKPZEIORHBOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FO3P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2.
What are the key properties of [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene?
[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene has a molecular weight of 280.24 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene is sourced from PubChem (CID 14175848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).