(3Z)-3-benzylidene-2-benzofuran-1-one

C15H10O2 — CID 642371

IUPAC(3Z)-3-benzylidene-2-benzofuran-1-one
SMILESO=C1O/C(=C\c2ccccc2)c2ccccc21
InChIInChI=1S/C15H10O2/c16-15-13-9-5-4-8-12(13)14(17-15)10-11-6-2-1-3-7-11/h1-10H/b14-10-
InChIKeyYRTPZXMEBGTPLM-UVTDQMKNSA-N
MW222.24 g/mol
LogP3.36
Rot. Bonds1

About (3Z)-3-benzylidene-2-benzofuran-1-one

(3Z)-3-benzylidene-2-benzofuran-1-one (PubChem CID 642371) has the molecular formula C15H10O2 and a molecular weight of 222.24 g/mol. Its IUPAC name is (3Z)-3-benzylidene-2-benzofuran-1-one.

Molecular Properties

Compound Name(3Z)-3-benzylidene-2-benzofuran-1-one
PubChem CID642371
Molecular FormulaC15H10O2
Molecular Weight222.24 g/mol
Exact Mass222.07
IUPAC Name(3Z)-3-benzylidene-2-benzofuran-1-one
SMILESO=C1O/C(=C\c2ccccc2)c2ccccc21
InChIInChI=1S/C15H10O2/c16-15-13-9-5-4-8-12(13)14(17-15)10-11-6-2-1-3-7-11/h1-10H/b14-10-
InChIKeyYRTPZXMEBGTPLM-UVTDQMKNSA-N
XLogP3.36
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-benzylidene-2-benzofuran-1-one?
The IUPAC name of (3Z)-3-benzylidene-2-benzofuran-1-one (CID 642371) is (3Z)-3-benzylidene-2-benzofuran-1-one.
What is the SMILES notation for (3Z)-3-benzylidene-2-benzofuran-1-one?
The canonical SMILES for (3Z)-3-benzylidene-2-benzofuran-1-one is O=C1O/C(=C\c2ccccc2)c2ccccc21.
What is the InChIKey of (3Z)-3-benzylidene-2-benzofuran-1-one?
The InChIKey is YRTPZXMEBGTPLM-UVTDQMKNSA-N. The full InChI is InChI=1S/C15H10O2/c16-15-13-9-5-4-8-12(13)14(17-15)10-11-6-2-1-3-7-11/h1-10H/b14-10-.
What are the key properties of (3Z)-3-benzylidene-2-benzofuran-1-one?
(3Z)-3-benzylidene-2-benzofuran-1-one has a molecular weight of 222.24 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-benzylidene-2-benzofuran-1-one is sourced from PubChem (CID 642371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).