fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane

C32H37P — CID 102303473

IUPACfluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane
SMILESCC(C)(C)c1cc(C(C)(C)C)c(P=C=C2c3ccccc3-c3ccccc32)c(C(C)(C)C)c1
InChIInChI=1S/C32H37P/c1-30(2,3)21-18-27(31(4,5)6)29(28(19-21)32(7,8)9)33-20-26-24-16-12-10-14-22(24)23-15-11-13-17-25(23)26/h10-19H,1-9H3
InChIKeyPWONETOHCADNPU-UHFFFAOYSA-N
MW452.62 g/mol
LogP8.66
Rot. Bonds1

About fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane

fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane (PubChem CID 102303473) has the molecular formula C32H37P and a molecular weight of 452.62 g/mol. Its IUPAC name is fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane.

Molecular Properties

Compound Namefluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane
PubChem CID102303473
Molecular FormulaC32H37P
Molecular Weight452.62 g/mol
Exact Mass452.26
IUPAC Namefluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane
SMILESCC(C)(C)c1cc(C(C)(C)C)c(P=C=C2c3ccccc3-c3ccccc32)c(C(C)(C)C)c1
InChIInChI=1S/C32H37P/c1-30(2,3)21-18-27(31(4,5)6)29(28(19-21)32(7,8)9)33-20-26-24-16-12-10-14-22(24)23-15-11-13-17-25(23)26/h10-19H,1-9H3
InChIKeyPWONETOHCADNPU-UHFFFAOYSA-N
XLogP8.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.62
LogP ≤ 58.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane with MolForge

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

Launch Full Analysis

Related Compounds

(2,7-ditert-butylfluoren-9-ylidene)-(2,4,6-tritert-butylphenyl)phosphane
CID 15821264
[2,3-dithiophen-2-yl-4-(2,4,6-tritert-butylphenyl)phosphanylidenebuta-1,3-dienylidene]-(2,4,6-tritert-butylphenyl)phosphane
CID 23421786
2,3-ditert-butyltetraphenylene
CID 166497085
phenyl-(2,4,6-tritert-butylphenyl)phosphanylidenephosphane
CID 13086218
2,4-ditert-butyl-1-[2-[2-(2,4-ditert-butylphenyl)phenyl]phenyl]benzene;phosphonous acid
CID 68656808
lithium diphenyl-[(2,4,6-tritert-butylphenyl)phosphanylidenemethyl]phosphane
CID 177462809
1-(2,4,6-tritert-butylphenyl)pentacene
CID 141153745
2,10-ditert-butyltetraphenylene
CID 159208403
(2,4,6-tritert-butylphenyl)-[[4-[(2,4,6-tritert-butylphenyl)phosphanylidenemethyl]phenyl]methylidene]phosphane
CID 15803042
benzene;carbon monoxide;(2,4,6-tritert-butylphenyl)phosphanylideneosmium
CID 134984450
[2,3-bis[bromo(phenyl)methyl]-4-(2,4,6-tritert-butylphenyl)phosphanylidenecyclobut-2-en-1-ylidene]-(2,4,6-tritert-butylphenyl)phosphane
CID 134888306
1-phenylpenta-1,4-diyn-3-ylidene-(2,4,6-tritert-butylphenyl)phosphane
CID 54771244

Frequently Asked Questions

What is the IUPAC name of fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane?
The IUPAC name of fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane (CID 102303473) is fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane.
What is the SMILES notation for fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane?
The canonical SMILES for fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane is CC(C)(C)c1cc(C(C)(C)C)c(P=C=C2c3ccccc3-c3ccccc32)c(C(C)(C)C)c1.
What is the InChIKey of fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane?
The InChIKey is PWONETOHCADNPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H37P/c1-30(2,3)21-18-27(31(4,5)6)29(28(19-21)32(7,8)9)33-20-26-24-16-12-10-14-22(24)23-15-11-13-17-25(23)26/h10-19H,1-9H3.
What are the key properties of fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane?
fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane has a molecular weight of 452.62 g/mol, XLogP of 8.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-9-ylidenemethylidene-(2,4,6-tritert-butylphenyl)phosphane is sourced from PubChem (CID 102303473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).