5-benzylidene-4-phenylfuran-2-one

C17H12O2 — CID 67301545

IUPAC5-benzylidene-4-phenylfuran-2-one
SMILESO=C1C=C(c2ccccc2)C(=Cc2ccccc2)O1
InChIInChI=1S/C17H12O2/c18-17-12-15(14-9-5-2-6-10-14)16(19-17)11-13-7-3-1-4-8-13/h1-12H
InChIKeyBSZTWDNOHAMWCZ-UHFFFAOYSA-N
MW248.28 g/mol
LogP3.67
Rot. Bonds2

About 5-benzylidene-4-phenylfuran-2-one

5-benzylidene-4-phenylfuran-2-one (PubChem CID 67301545) has the molecular formula C17H12O2 and a molecular weight of 248.28 g/mol. Its IUPAC name is 5-benzylidene-4-phenylfuran-2-one.

Molecular Properties

Compound Name5-benzylidene-4-phenylfuran-2-one
PubChem CID67301545
Molecular FormulaC17H12O2
Molecular Weight248.28 g/mol
Exact Mass248.08
IUPAC Name5-benzylidene-4-phenylfuran-2-one
SMILESO=C1C=C(c2ccccc2)C(=Cc2ccccc2)O1
InChIInChI=1S/C17H12O2/c18-17-12-15(14-9-5-2-6-10-14)16(19-17)11-13-7-3-1-4-8-13/h1-12H
InChIKeyBSZTWDNOHAMWCZ-UHFFFAOYSA-N
XLogP3.67
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5Z)-5-benzylidene-4-(4-methylphenyl)furan-2-one
CID 102259031
(5Z)-4-(4-methoxyphenyl)-5-[(4-methoxyphenyl)methylidene]furan-2-one
CID 11587605
5-benzylidene-4-phenylsulfanylfuran-2-one
CID 71338715
(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one
CID 24825845
CID 173420275
CID 173420275
(5Z)-5-(bromomethylidene)-3-phenylfuran-2-one
CID 25130586
(5Z)-4-(2-fluorophenyl)-5-[(2-fluorophenyl)methylidene]furan-2-one
CID 58369804
(3Z)-3-[[4-[(Z)-(2-oxo-5-phenylfuran-3-ylidene)methyl]phenyl]methylidene]-5-phenylfuran-2-one
CID 11984182
(4Z)-4-benzylidene-6-phenylpyran-2-one
CID 134105973
(2Z)-2-benzylidenebenzo[g][1,4]benzodioxin-3-one
CID 102402209
3-(4-bromophenyl)furan-2,5-dione
CID 602818
(5Z)-5-[(2,2-dimethylchromen-6-yl)methylidene]-4-(4-hydroxyphenyl)furan-2-one
CID 142740294

Frequently Asked Questions

What is the IUPAC name of 5-benzylidene-4-phenylfuran-2-one?
The IUPAC name of 5-benzylidene-4-phenylfuran-2-one (CID 67301545) is 5-benzylidene-4-phenylfuran-2-one.
What is the SMILES notation for 5-benzylidene-4-phenylfuran-2-one?
The canonical SMILES for 5-benzylidene-4-phenylfuran-2-one is O=C1C=C(c2ccccc2)C(=Cc2ccccc2)O1.
What is the InChIKey of 5-benzylidene-4-phenylfuran-2-one?
The InChIKey is BSZTWDNOHAMWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12O2/c18-17-12-15(14-9-5-2-6-10-14)16(19-17)11-13-7-3-1-4-8-13/h1-12H.
What are the key properties of 5-benzylidene-4-phenylfuran-2-one?
5-benzylidene-4-phenylfuran-2-one has a molecular weight of 248.28 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzylidene-4-phenylfuran-2-one is sourced from PubChem (CID 67301545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).