(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane

C18H16O — CID 24975514

IUPAC(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane
SMILESC=C1/C(=C/c2ccccc2)COC1c1ccccc1
InChIInChI=1S/C18H16O/c1-14-17(12-15-8-4-2-5-9-15)13-19-18(14)16-10-6-3-7-11-16/h2-12,18H,1,13H2/b17-12+
InChIKeyBRACVYADXPGIAX-SFQUDFHCSA-N
MW248.32 g/mol
LogP4.40
Rot. Bonds2

About (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane

(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane (PubChem CID 24975514) has the molecular formula C18H16O and a molecular weight of 248.32 g/mol. Its IUPAC name is (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane.

Molecular Properties

Compound Name(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane
PubChem CID24975514
Molecular FormulaC18H16O
Molecular Weight248.32 g/mol
Exact Mass248.12
IUPAC Name(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane
SMILESC=C1/C(=C/c2ccccc2)COC1c1ccccc1
InChIInChI=1S/C18H16O/c1-14-17(12-15-8-4-2-5-9-15)13-19-18(14)16-10-6-3-7-11-16/h2-12,18H,1,13H2/b17-12+
InChIKeyBRACVYADXPGIAX-SFQUDFHCSA-N
XLogP4.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane?
The IUPAC name of (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane (CID 24975514) is (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane.
What is the SMILES notation for (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane?
The canonical SMILES for (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane is C=C1/C(=C/c2ccccc2)COC1c1ccccc1.
What is the InChIKey of (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane?
The InChIKey is BRACVYADXPGIAX-SFQUDFHCSA-N. The full InChI is InChI=1S/C18H16O/c1-14-17(12-15-8-4-2-5-9-15)13-19-18(14)16-10-6-3-7-11-16/h2-12,18H,1,13H2/b17-12+.
What are the key properties of (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane?
(4Z)-4-benzylidene-3-methylidene-2-phenyloxolane has a molecular weight of 248.32 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-3-methylidene-2-phenyloxolane is sourced from PubChem (CID 24975514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).