9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene

C40H26 — CID 23385449

IUPAC9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene
SMILESC(=C1c2ccccc2-c2ccccc21)c1ccc(-c2ccc(C=C3c4ccccc4-c4ccccc43)cc2)cc1
InChIInChI=1S/C40H26/c1-5-13-35-31(9-1)32-10-2-6-14-36(32)39(35)25-27-17-21-29(22-18-27)30-23-19-28(20-24-30)26-40-37-15-7-3-11-33(37)34-12-4-8-16-38(34)40/h1-26H
InChIKeyCLVMMBWPIVRQAQ-UHFFFAOYSA-N
MW506.65 g/mol
LogP10.49
Rot. Bonds3

About 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene

9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene (PubChem CID 23385449) has the molecular formula C40H26 and a molecular weight of 506.65 g/mol. Its IUPAC name is 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene.

Molecular Properties

Compound Name9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene
PubChem CID23385449
Molecular FormulaC40H26
Molecular Weight506.65 g/mol
Exact Mass506.20
IUPAC Name9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene
SMILESC(=C1c2ccccc2-c2ccccc21)c1ccc(-c2ccc(C=C3c4ccccc4-c4ccccc43)cc2)cc1
InChIInChI=1S/C40H26/c1-5-13-35-31(9-1)32-10-2-6-14-36(32)39(35)25-27-17-21-29(22-18-27)30-23-19-28(20-24-30)26-40-37-15-7-3-11-33(37)34-12-4-8-16-38(34)40/h1-26H
InChIKeyCLVMMBWPIVRQAQ-UHFFFAOYSA-N
XLogP10.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.65
LogP ≤ 510.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene?
The IUPAC name of 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene (CID 23385449) is 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene.
What is the SMILES notation for 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene?
The canonical SMILES for 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene is C(=C1c2ccccc2-c2ccccc21)c1ccc(-c2ccc(C=C3c4ccccc4-c4ccccc43)cc2)cc1.
What is the InChIKey of 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene?
The InChIKey is CLVMMBWPIVRQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26/c1-5-13-35-31(9-1)32-10-2-6-14-36(32)39(35)25-27-17-21-29(22-18-27)30-23-19-28(20-24-30)26-40-37-15-7-3-11-33(37)34-12-4-8-16-38(34)40/h1-26H.
What are the key properties of 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene?
9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene has a molecular weight of 506.65 g/mol, XLogP of 10.49, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[[4-[4-(fluoren-9-ylidenemethyl)phenyl]phenyl]methylidene]fluorene is sourced from PubChem (CID 23385449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).