1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene

C32H23OP — CID 151192762

IUPAC1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene
SMILESO=P(c1ccccc1)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C32H23OP/c33-34(24-12-2-1-3-13-24,31-18-8-16-27-25-14-6-4-10-22(25)20-29(27)31)32-19-9-17-28-26-15-7-5-11-23(26)21-30(28)32/h1-19H,20-21H2
InChIKeyNGQXJYYBWAANDT-UHFFFAOYSA-N
MW454.51 g/mol
LogP6.47
Rot. Bonds3

About 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene

1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene (PubChem CID 151192762) has the molecular formula C32H23OP and a molecular weight of 454.51 g/mol. Its IUPAC name is 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene.

Molecular Properties

Compound Name1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene
PubChem CID151192762
Molecular FormulaC32H23OP
Molecular Weight454.51 g/mol
Exact Mass454.15
IUPAC Name1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene
SMILESO=P(c1ccccc1)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C32H23OP/c33-34(24-12-2-1-3-13-24,31-18-8-16-27-25-14-6-4-10-22(25)20-29(27)31)32-19-9-17-28-26-15-7-5-11-23(26)21-30(28)32/h1-19H,20-21H2
InChIKeyNGQXJYYBWAANDT-UHFFFAOYSA-N
XLogP6.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.51
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[[2-(2-methylpropyl)phenyl]-phenylphosphoryl]-9H-fluorene
CID 152525738
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
CID 123562270
CID 123562270
2-[phenyl-(2-sulfanylphenyl)phosphoryl]benzenethiol
CID 15409952
1-[9H-fluoren-1-yl(diphenyl)methyl]-9H-fluorene
CID 141254702
1-[2-[9H-fluoren-1-yl(methoxy)phosphoryl]phenyl]prop-2-en-1-one
CID 152566854
Fluorenylsilane
CID 22104606
1-[2-(4-phenylphenyl)phenyl]-9H-fluorene
CID 174460318
bis(9H-fluoren-1-yl)mercury
CID 154196677
6-(9H-fluoren-1-yl)pyridine-2-carboxylic acid
CID 150263501
acetic acid;1-(9H-fluoren-1-yloxy)-9H-fluorene
CID 162313144

Frequently Asked Questions

What is the IUPAC name of 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene?
The IUPAC name of 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene (CID 151192762) is 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene.
What is the SMILES notation for 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene?
The canonical SMILES for 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene is O=P(c1ccccc1)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene?
The InChIKey is NGQXJYYBWAANDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23OP/c33-34(24-12-2-1-3-13-24,31-18-8-16-27-25-14-6-4-10-22(25)20-29(27)31)32-19-9-17-28-26-15-7-5-11-23(26)21-30(28)32/h1-19H,20-21H2.
What are the key properties of 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene?
1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene has a molecular weight of 454.51 g/mol, XLogP of 6.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[9H-fluoren-1-yl(phenyl)phosphoryl]-9H-fluorene is sourced from PubChem (CID 151192762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).