1-[methyl(phenyl)phosphoryl]-3-phenylbenzene

C19H17OP — CID 57015160

IUPAC1-[methyl(phenyl)phosphoryl]-3-phenylbenzene
SMILESCP(=O)(c1ccccc1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H17OP/c1-21(20,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3
InChIKeySUAYZTNYLIZMIE-UHFFFAOYSA-N
MW292.32 g/mol
LogP4.30
Rot. Bonds3

About 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene

1-[methyl(phenyl)phosphoryl]-3-phenylbenzene (PubChem CID 57015160) has the molecular formula C19H17OP and a molecular weight of 292.32 g/mol. Its IUPAC name is 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene.

Molecular Properties

Compound Name1-[methyl(phenyl)phosphoryl]-3-phenylbenzene
PubChem CID57015160
Molecular FormulaC19H17OP
Molecular Weight292.32 g/mol
Exact Mass292.10
IUPAC Name1-[methyl(phenyl)phosphoryl]-3-phenylbenzene
SMILESCP(=O)(c1ccccc1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H17OP/c1-21(20,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3
InChIKeySUAYZTNYLIZMIE-UHFFFAOYSA-N
XLogP4.30
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene?
The IUPAC name of 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene (CID 57015160) is 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene.
What is the SMILES notation for 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene?
The canonical SMILES for 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene is CP(=O)(c1ccccc1)c1cccc(-c2ccccc2)c1.
What is the InChIKey of 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene?
The InChIKey is SUAYZTNYLIZMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17OP/c1-21(20,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3.
What are the key properties of 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene?
1-[methyl(phenyl)phosphoryl]-3-phenylbenzene has a molecular weight of 292.32 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(phenyl)phosphoryl]-3-phenylbenzene is sourced from PubChem (CID 57015160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).