9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene

C36H26O2 — CID 90396431

IUPAC9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene
SMILESCOc1cc(C=C2c3ccccc3-c3ccccc32)c(OC)cc1C=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C36H26O2/c1-37-35-21-24(20-34-31-17-9-5-13-27(31)28-14-6-10-18-32(28)34)36(38-2)22-23(35)19-33-29-15-7-3-11-25(29)26-12-4-8-16-30(26)33/h3-22H,1-2H3
InChIKeyVICQYKNWQLQFJC-UHFFFAOYSA-N
MW490.60 g/mol
LogP8.84
Rot. Bonds4

About 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene

9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene (PubChem CID 90396431) has the molecular formula C36H26O2 and a molecular weight of 490.60 g/mol. Its IUPAC name is 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene.

Molecular Properties

Compound Name9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene
PubChem CID90396431
Molecular FormulaC36H26O2
Molecular Weight490.60 g/mol
Exact Mass490.19
IUPAC Name9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene
SMILESCOc1cc(C=C2c3ccccc3-c3ccccc32)c(OC)cc1C=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C36H26O2/c1-37-35-21-24(20-34-31-17-9-5-13-27(31)28-14-6-10-18-32(28)34)36(38-2)22-23(35)19-33-29-15-7-3-11-25(29)26-12-4-8-16-30(26)33/h3-22H,1-2H3
InChIKeyVICQYKNWQLQFJC-UHFFFAOYSA-N
XLogP8.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.60
LogP ≤ 58.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2,5-bis(fluoren-9-ylidenemethyl)-4-methoxyphenyl]methanol
CID 90394354
9-[(4,5-dimethoxy-2-nitrophenyl)methylidene]fluorene
CID 101464411
(3E)-1-methyl-3-[(2,4,5-trimethoxyphenyl)methylidene]indol-2-one
CID 7528411
(3E)-3-[(2,5-dimethoxy-4-methylphenyl)methylidene]-1H-indol-2-one
CID 112979013
5-[(10-iminoanthracen-9-ylidene)methyl]-2-methoxyphenol
CID 142965156
10-[(4-hydroxy-3-methoxyphenyl)methylidene]anthracen-9-one
CID 12516081
1-ethenyl-2-(2-methoxyphenyl)benzene
CID 150139111
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
3-[(5-bromo-2-methoxyphenyl)methylidene]-1-methylindol-2-one
CID 3496594
1-(2-methoxyphenyl)-5-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
CID 1353274
10-[(3,5-dimethoxyphenyl)methylidene]anthracen-9-one
CID 11002381
(3Z)-3-[(4,5-dimethoxy-2-methylphenyl)methylidene]-1-ethylindol-2-one
CID 126119662

Frequently Asked Questions

What is the IUPAC name of 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene?
The IUPAC name of 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene (CID 90396431) is 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene.
What is the SMILES notation for 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene?
The canonical SMILES for 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene is COc1cc(C=C2c3ccccc3-c3ccccc32)c(OC)cc1C=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene?
The InChIKey is VICQYKNWQLQFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26O2/c1-37-35-21-24(20-34-31-17-9-5-13-27(31)28-14-6-10-18-32(28)34)36(38-2)22-23(35)19-33-29-15-7-3-11-25(29)26-12-4-8-16-30(26)33/h3-22H,1-2H3.
What are the key properties of 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene?
9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene has a molecular weight of 490.60 g/mol, XLogP of 8.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[[4-(fluoren-9-ylidenemethyl)-2,5-dimethoxyphenyl]methylidene]fluorene is sourced from PubChem (CID 90396431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).