benzyl methyl phenyl phosphite

C14H15O3P — CID 19107157

IUPACbenzyl methyl phenyl phosphite
SMILESCOP(OCc1ccccc1)Oc1ccccc1
InChIInChI=1S/C14H15O3P/c1-15-18(17-14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-11H,12H2,1H3
InChIKeyOYWFRRHUFJHGPH-UHFFFAOYSA-N
MW262.25 g/mol
LogP4.16
Rot. Bonds6

About benzyl methyl phenyl phosphite

benzyl methyl phenyl phosphite (PubChem CID 19107157) has the molecular formula C14H15O3P and a molecular weight of 262.25 g/mol. Its IUPAC name is benzyl methyl phenyl phosphite.

Molecular Properties

Compound Namebenzyl methyl phenyl phosphite
PubChem CID19107157
Molecular FormulaC14H15O3P
Molecular Weight262.25 g/mol
Exact Mass262.08
IUPAC Namebenzyl methyl phenyl phosphite
SMILESCOP(OCc1ccccc1)Oc1ccccc1
InChIInChI=1S/C14H15O3P/c1-15-18(17-14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-11H,12H2,1H3
InChIKeyOYWFRRHUFJHGPH-UHFFFAOYSA-N
XLogP4.16
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.25
LogP ≤ 54.16
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

ethane;methyl diphenyl phosphite
CID 161074644
tribenzyl phosphite
CID 11810300
[4-(benzenesulfonyl)phenyl]methyl dimethyl phosphite
CID 172699258
dibenzyl 1-[di(propan-2-yl)amino]ethyl phosphite
CID 174548244
triphenyl phosphite
CID 7540
tri(113C)cyclohexatrienyl phosphite
CID 101432390
diphenoxyphosphanyloxymethyl diphenyl phosphite
CID 171611986
chloromethylbenzene;triphenyl phosphite
CID 158515222
lithium;hydride;methoxymethylbenzene
CID 174456658
benzyl bis(prop-2-enyl) phosphite
CID 18961624
methoxymethylbenzene;silane
CID 174277199
methoxymethylbenzene;vanadium
CID 167445376

Frequently Asked Questions

What is the IUPAC name of benzyl methyl phenyl phosphite?
The IUPAC name of benzyl methyl phenyl phosphite (CID 19107157) is benzyl methyl phenyl phosphite.
What is the SMILES notation for benzyl methyl phenyl phosphite?
The canonical SMILES for benzyl methyl phenyl phosphite is COP(OCc1ccccc1)Oc1ccccc1.
What is the InChIKey of benzyl methyl phenyl phosphite?
The InChIKey is OYWFRRHUFJHGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15O3P/c1-15-18(17-14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-11H,12H2,1H3.
What are the key properties of benzyl methyl phenyl phosphite?
benzyl methyl phenyl phosphite has a molecular weight of 262.25 g/mol, XLogP of 4.16, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl methyl phenyl phosphite is sourced from PubChem (CID 19107157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).