2-chloro-3-(2-phenylethenyl)phenol

C14H11ClO — CID 70555314

IUPAC2-chloro-3-(2-phenylethenyl)phenol
SMILESOc1cccc(C=Cc2ccccc2)c1Cl
InChIInChI=1S/C14H11ClO/c15-14-12(7-4-8-13(14)16)10-9-11-5-2-1-3-6-11/h1-10,16H
InChIKeySOIBUHYAWURSEG-UHFFFAOYSA-N
MW230.69 g/mol
LogP4.22
Rot. Bonds2

About 2-chloro-3-(2-phenylethenyl)phenol

2-chloro-3-(2-phenylethenyl)phenol (PubChem CID 70555314) has the molecular formula C14H11ClO and a molecular weight of 230.69 g/mol. Its IUPAC name is 2-chloro-3-(2-phenylethenyl)phenol.

Molecular Properties

Compound Name2-chloro-3-(2-phenylethenyl)phenol
PubChem CID70555314
Molecular FormulaC14H11ClO
Molecular Weight230.69 g/mol
Exact Mass230.05
IUPAC Name2-chloro-3-(2-phenylethenyl)phenol
SMILESOc1cccc(C=Cc2ccccc2)c1Cl
InChIInChI=1S/C14H11ClO/c15-14-12(7-4-8-13(14)16)10-9-11-5-2-1-3-6-11/h1-10,16H
InChIKeySOIBUHYAWURSEG-UHFFFAOYSA-N
XLogP4.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.69
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-chloro-3-(2-phenylethenyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
2-(2-phenylethenyl)phenol;phosphoric acid
CID 67814298
2-methyl-6-[(E)-2-phenylethenyl]phenol
CID 22713146
2-chloro-3-ethenylphenol
CID 22627876
2-chloro-3-(4-hydroxybut-1-enyl)phenol
CID 170476157
2-[(E)-2-isocyanoethenyl]-3-[(E)-2-phenylethenyl]phenol
CID 175848025
tetrakis[2-[(E)-2-phenylethenyl]phenyl]silane
CID 22630526
2-(2-phenylethenyl)benzene-1,4-diol
CID 54196246
2-chloro-5-(2-phenylethenyl)phenol
CID 174326276
2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol
CID 174746341
1-(2-phenylethenyl)biphenylene
CID 142709250
2-chlorophenol;[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
CID 88755430

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(2-phenylethenyl)phenol?
The IUPAC name of 2-chloro-3-(2-phenylethenyl)phenol (CID 70555314) is 2-chloro-3-(2-phenylethenyl)phenol.
What is the SMILES notation for 2-chloro-3-(2-phenylethenyl)phenol?
The canonical SMILES for 2-chloro-3-(2-phenylethenyl)phenol is Oc1cccc(C=Cc2ccccc2)c1Cl.
What is the InChIKey of 2-chloro-3-(2-phenylethenyl)phenol?
The InChIKey is SOIBUHYAWURSEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClO/c15-14-12(7-4-8-13(14)16)10-9-11-5-2-1-3-6-11/h1-10,16H.
What are the key properties of 2-chloro-3-(2-phenylethenyl)phenol?
2-chloro-3-(2-phenylethenyl)phenol has a molecular weight of 230.69 g/mol, XLogP of 4.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(2-phenylethenyl)phenol is sourced from PubChem (CID 70555314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).