2-[(E)-2-phenylethenyl]phenolate

C14H11O- — CID 23105470

IUPAC2-[(E)-2-phenylethenyl]phenolate
SMILES[O-]c1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C14H12O/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-11,15H/p-1/b11-10+
InChIKeyAYPZAZPOYROADP-ZHACJKMWSA-M
MW195.24 g/mol
LogP2.93
Rot. Bonds2

About 2-[(E)-2-phenylethenyl]phenolate

2-[(E)-2-phenylethenyl]phenolate (PubChem CID 23105470) has the molecular formula C14H11O- and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-[(E)-2-phenylethenyl]phenolate.

Molecular Properties

Compound Name2-[(E)-2-phenylethenyl]phenolate
PubChem CID23105470
Molecular FormulaC14H11O-
Molecular Weight195.24 g/mol
Exact Mass195.08
IUPAC Name2-[(E)-2-phenylethenyl]phenolate
SMILES[O-]c1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C14H12O/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-11,15H/p-1/b11-10+
InChIKeyAYPZAZPOYROADP-ZHACJKMWSA-M
XLogP2.93
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
tetrakis[2-[(E)-2-phenylethenyl]phenyl]silane
CID 22630526
CID 70567885
CID 70567885
CID 70569152
CID 70569152
1-fluoro-2-[(Z)-2-phenylethenyl]benzene
CID 46218050
3-[2-(2-phenylethenyl)phenyl]prop-2-enoic acid
CID 70472676
hydride;rubidium(1+);stilbene
CID 173437843
disodium;hydride;(E)-stilbene
CID 173089328
2-[2-[2-(2-phenylethenyl)phenyl]ethenyl]pyridine
CID 154926324
2,6-bis[2-[(E)-2-phenylethenyl]phenyl]pyridine
CID 102597528
2-[2-(2-phenylethenyl)phenyl]pyrimidine
CID 141475746
1-(2-phenylethenyl)biphenylene
CID 142709250

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-phenylethenyl]phenolate?
The IUPAC name of 2-[(E)-2-phenylethenyl]phenolate (CID 23105470) is 2-[(E)-2-phenylethenyl]phenolate.
What is the SMILES notation for 2-[(E)-2-phenylethenyl]phenolate?
The canonical SMILES for 2-[(E)-2-phenylethenyl]phenolate is [O-]c1ccccc1/C=C/c1ccccc1.
What is the InChIKey of 2-[(E)-2-phenylethenyl]phenolate?
The InChIKey is AYPZAZPOYROADP-ZHACJKMWSA-M. The full InChI is InChI=1S/C14H12O/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-11,15H/p-1/b11-10+.
What are the key properties of 2-[(E)-2-phenylethenyl]phenolate?
2-[(E)-2-phenylethenyl]phenolate has a molecular weight of 195.24 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-phenylethenyl]phenolate is sourced from PubChem (CID 23105470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).