bis(phenylmethoxy)phosphorylformonitrile

C15H14NO3P — CID 57241641

IUPACbis(phenylmethoxy)phosphorylformonitrile
SMILESN#CP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H14NO3P/c16-13-20(17,18-11-14-7-3-1-4-8-14)19-12-15-9-5-2-6-10-15/h1-10H,11-12H2
InChIKeyLUNAXADCKFYZOC-UHFFFAOYSA-N
MW287.26 g/mol
LogP4.09
Rot. Bonds6

About bis(phenylmethoxy)phosphorylformonitrile

bis(phenylmethoxy)phosphorylformonitrile (PubChem CID 57241641) has the molecular formula C15H14NO3P and a molecular weight of 287.26 g/mol. Its IUPAC name is bis(phenylmethoxy)phosphorylformonitrile.

Molecular Properties

Compound Namebis(phenylmethoxy)phosphorylformonitrile
PubChem CID57241641
Molecular FormulaC15H14NO3P
Molecular Weight287.26 g/mol
Exact Mass287.07
IUPAC Namebis(phenylmethoxy)phosphorylformonitrile
SMILESN#CP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H14NO3P/c16-13-20(17,18-11-14-7-3-1-4-8-14)19-12-15-9-5-2-6-10-15/h1-10H,11-12H2
InChIKeyLUNAXADCKFYZOC-UHFFFAOYSA-N
XLogP4.09
TPSA59.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.26
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

sodium;bis(phenylmethoxy)phosphorylcyanamide;hydride
CID 173399282
[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene
CID 14175848
bis(phenylmethoxy)phosphorylboranuide
CID 157313450
dibenzyl hydrogen phosphate;silver
CID 85301331
[hydroxy(phenylmethoxy)phosphoryl]phosphonic acid
CID 87473581
N,N-dibenzyl-cyanophosphonamidic acid
CID 70187958
3-bis(phenylmethoxy)phosphorylpropanoic acid
CID 46223844
[[bromo(difluoro)methyl]-phenylmethoxyphosphoryl]oxymethylbenzene
CID 19751870
[phenylmethoxy(phenylsulfanyl)phosphoryl]oxymethylbenzene
CID 90676738
1-bis(phenylmethoxy)phosphorylethanone
CID 12524609
phenylmethoxymethylbenzene;phosphoric acid
CID 141118417
2-phenylethyl(phenylmethoxy)phosphinic acid
CID 54325821

Frequently Asked Questions

What is the IUPAC name of bis(phenylmethoxy)phosphorylformonitrile?
The IUPAC name of bis(phenylmethoxy)phosphorylformonitrile (CID 57241641) is bis(phenylmethoxy)phosphorylformonitrile.
What is the SMILES notation for bis(phenylmethoxy)phosphorylformonitrile?
The canonical SMILES for bis(phenylmethoxy)phosphorylformonitrile is N#CP(=O)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of bis(phenylmethoxy)phosphorylformonitrile?
The InChIKey is LUNAXADCKFYZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14NO3P/c16-13-20(17,18-11-14-7-3-1-4-8-14)19-12-15-9-5-2-6-10-15/h1-10H,11-12H2.
What are the key properties of bis(phenylmethoxy)phosphorylformonitrile?
bis(phenylmethoxy)phosphorylformonitrile has a molecular weight of 287.26 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(phenylmethoxy)phosphorylformonitrile is sourced from PubChem (CID 57241641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).