9-butylidene-2,7-bis(4-phenylphenyl)fluorene

C41H32 — CID 141305540

IUPAC9-butylidene-2,7-bis(4-phenylphenyl)fluorene
SMILESCCCC=C1c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccc4)cc3)cc21
InChIInChI=1S/C41H32/c1-2-3-14-37-40-27-35(33-19-15-31(16-20-33)29-10-6-4-7-11-29)23-25-38(40)39-26-24-36(28-41(37)39)34-21-17-32(18-22-34)30-12-8-5-9-13-30/h4-28H,2-3H2,1H3
InChIKeySUFMAXWEWADCQK-UHFFFAOYSA-N
MW524.71 g/mol
LogP11.57
Rot. Bonds6

About 9-butylidene-2,7-bis(4-phenylphenyl)fluorene

9-butylidene-2,7-bis(4-phenylphenyl)fluorene (PubChem CID 141305540) has the molecular formula C41H32 and a molecular weight of 524.71 g/mol. Its IUPAC name is 9-butylidene-2,7-bis(4-phenylphenyl)fluorene.

Molecular Properties

Compound Name9-butylidene-2,7-bis(4-phenylphenyl)fluorene
PubChem CID141305540
Molecular FormulaC41H32
Molecular Weight524.71 g/mol
Exact Mass524.25
IUPAC Name9-butylidene-2,7-bis(4-phenylphenyl)fluorene
SMILESCCCC=C1c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccc4)cc3)cc21
InChIInChI=1S/C41H32/c1-2-3-14-37-40-27-35(33-19-15-31(16-20-33)29-10-6-4-7-11-29)23-25-38(40)39-26-24-36(28-41(37)39)34-21-17-32(18-22-34)30-12-8-5-9-13-30/h4-28H,2-3H2,1H3
InChIKeySUFMAXWEWADCQK-UHFFFAOYSA-N
XLogP11.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.71
LogP ≤ 511.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-butylidene-2,7-bis(4-phenylphenyl)fluorene 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

11-phenylnonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1(32),2(48),3,5(47),6(46),7,9(45),10,12,14(42),15,17(41),18,20,22,24,26,28,30,33,35,37,39,43-tetracosaene
CID 135036112
1,2,4-triphenylbenzene
CID 518325
1-ethyl-2,4-diphenylbenzene
CID 59359551
9-hexylidenefluorene
CID 58121399
2-ethyl-5-phenylisoindole-1,3-dione
CID 58482896
1-[(Z)-pent-1-enyl]-3-phenylbenzene
CID 177453433
azane;1,1'-biphenyl;butane
CID 155168826
1,2,4-triphenylbenzene;1,3,5-triphenylbenzene
CID 162004033
1-(2,4-diphenylphenyl)propan-1-one
CID 151246876
2-(4-phenylphenyl)bicyclo[2.2.0]hexa-1,3,5-triene
CID 174878589
1-methyl-4-phenyl-2-(4-propylphenyl)benzene
CID 123627409
3,3',7,7'-tetrakis(4-phenylphenyl)-5,5'-spirobi[benzo[b][1]benzosilole]
CID 20710018

Frequently Asked Questions

What is the IUPAC name of 9-butylidene-2,7-bis(4-phenylphenyl)fluorene?
The IUPAC name of 9-butylidene-2,7-bis(4-phenylphenyl)fluorene (CID 141305540) is 9-butylidene-2,7-bis(4-phenylphenyl)fluorene.
What is the SMILES notation for 9-butylidene-2,7-bis(4-phenylphenyl)fluorene?
The canonical SMILES for 9-butylidene-2,7-bis(4-phenylphenyl)fluorene is CCCC=C1c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.
What is the InChIKey of 9-butylidene-2,7-bis(4-phenylphenyl)fluorene?
The InChIKey is SUFMAXWEWADCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H32/c1-2-3-14-37-40-27-35(33-19-15-31(16-20-33)29-10-6-4-7-11-29)23-25-38(40)39-26-24-36(28-41(37)39)34-21-17-32(18-22-34)30-12-8-5-9-13-30/h4-28H,2-3H2,1H3.
What are the key properties of 9-butylidene-2,7-bis(4-phenylphenyl)fluorene?
9-butylidene-2,7-bis(4-phenylphenyl)fluorene has a molecular weight of 524.71 g/mol, XLogP of 11.57, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-butylidene-2,7-bis(4-phenylphenyl)fluorene is sourced from PubChem (CID 141305540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).