2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol

C54H43EuF3O4P2 — CID 59762603

IUPAC2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc2ccccc2c1-c1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12.OC(CC(O)C(F)(F)F)c1ccccc1.[Eu]
InChIInChI=1S/C44H32O2P2.C10H11F3O2.Eu/c45-47(35-19-5-1-6-20-35,36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)48(46,37-23-9-3-10-24-37)38-25-11-4-12-26-38;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;/h1-32H;1-5,8-9,14-15H,6H2;
InChIKeyDZBHCWOFXCBKNC-UHFFFAOYSA-N
MW1026.84 g/mol
LogP10.97
Rot. Bonds10

About 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol

2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol (PubChem CID 59762603) has the molecular formula C54H43EuF3O4P2 and a molecular weight of 1026.84 g/mol. Its IUPAC name is 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol.

Molecular Properties

Compound Name2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol
PubChem CID59762603
Molecular FormulaC54H43EuF3O4P2
Molecular Weight1026.84 g/mol
Exact Mass1027.18
IUPAC Name2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc2ccccc2c1-c1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12.OC(CC(O)C(F)(F)F)c1ccccc1.[Eu]
InChIInChI=1S/C44H32O2P2.C10H11F3O2.Eu/c45-47(35-19-5-1-6-20-35,36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)48(46,37-23-9-3-10-24-37)38-25-11-4-12-26-38;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;/h1-32H;1-5,8-9,14-15H,6H2;
InChIKeyDZBHCWOFXCBKNC-UHFFFAOYSA-N
XLogP10.97
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001026.84
LogP ≤ 510.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol?
The IUPAC name of 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol (CID 59762603) is 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol.
What is the SMILES notation for 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol?
The canonical SMILES for 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol is O=P(c1ccccc1)(c1ccccc1)c1ccc2ccccc2c1-c1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12.OC(CC(O)C(F)(F)F)c1ccccc1.[Eu].
What is the InChIKey of 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol?
The InChIKey is DZBHCWOFXCBKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H32O2P2.C10H11F3O2.Eu/c45-47(35-19-5-1-6-20-35,36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)48(46,37-23-9-3-10-24-37)38-25-11-4-12-26-38;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;/h1-32H;1-5,8-9,14-15H,6H2;.
What are the key properties of 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol?
2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol has a molecular weight of 1026.84 g/mol, XLogP of 10.97, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;europium;4,4,4-trifluoro-1-phenylbutane-1,3-diol is sourced from PubChem (CID 59762603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).