(E)-1,2-diphenylethene-1,2-diolate

C14H10O2-2 — CID 14292352

IUPAC(E)-1,2-diphenylethene-1,2-diolate
SMILES[O-]/C(=C(/[O-])c1ccccc1)c1ccccc1
InChIInChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,15-16H/p-2/b14-13+
InChIKeyIEVIXDLZSRLUHW-BUHFOSPRSA-L
MW210.23 g/mol
LogP1.23
Rot. Bonds2

About (E)-1,2-diphenylethene-1,2-diolate

(E)-1,2-diphenylethene-1,2-diolate (PubChem CID 14292352) has the molecular formula C14H10O2-2 and a molecular weight of 210.23 g/mol. Its IUPAC name is (E)-1,2-diphenylethene-1,2-diolate.

Molecular Properties

Compound Name(E)-1,2-diphenylethene-1,2-diolate
PubChem CID14292352
Molecular FormulaC14H10O2-2
Molecular Weight210.23 g/mol
Exact Mass210.07
IUPAC Name(E)-1,2-diphenylethene-1,2-diolate
SMILES[O-]/C(=C(/[O-])c1ccccc1)c1ccccc1
InChIInChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,15-16H/p-2/b14-13+
InChIKeyIEVIXDLZSRLUHW-BUHFOSPRSA-L
XLogP1.23
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

(Z)-2-hydroxy-3-oxo-1,3-diphenylprop-1-en-1-olate
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calcium dibenzoate
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Frequently Asked Questions

What is the IUPAC name of (E)-1,2-diphenylethene-1,2-diolate?
The IUPAC name of (E)-1,2-diphenylethene-1,2-diolate (CID 14292352) is (E)-1,2-diphenylethene-1,2-diolate.
What is the SMILES notation for (E)-1,2-diphenylethene-1,2-diolate?
The canonical SMILES for (E)-1,2-diphenylethene-1,2-diolate is [O-]/C(=C(/[O-])c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-1,2-diphenylethene-1,2-diolate?
The InChIKey is IEVIXDLZSRLUHW-BUHFOSPRSA-L. The full InChI is InChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,15-16H/p-2/b14-13+.
What are the key properties of (E)-1,2-diphenylethene-1,2-diolate?
(E)-1,2-diphenylethene-1,2-diolate has a molecular weight of 210.23 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2-diphenylethene-1,2-diolate is sourced from PubChem (CID 14292352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).