1-chloro-2-[(E)-1,2-diphenylethenyl]benzene

C20H15Cl — CID 175564265

IUPAC1-chloro-2-[(E)-1,2-diphenylethenyl]benzene
SMILESClc1ccccc1/C(=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15Cl/c21-20-14-8-7-13-18(20)19(17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-15H/b19-15+
InChIKeyCOVBDPUXLPXGFK-XDJHFCHBSA-N
MW290.79 g/mol
LogP5.93
Rot. Bonds3

About 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene

1-chloro-2-[(E)-1,2-diphenylethenyl]benzene (PubChem CID 175564265) has the molecular formula C20H15Cl and a molecular weight of 290.79 g/mol. Its IUPAC name is 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene.

Molecular Properties

Compound Name1-chloro-2-[(E)-1,2-diphenylethenyl]benzene
PubChem CID175564265
Molecular FormulaC20H15Cl
Molecular Weight290.79 g/mol
Exact Mass290.09
IUPAC Name1-chloro-2-[(E)-1,2-diphenylethenyl]benzene
SMILESClc1ccccc1/C(=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15Cl/c21-20-14-8-7-13-18(20)19(17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-15H/b19-15+
InChIKeyCOVBDPUXLPXGFK-XDJHFCHBSA-N
XLogP5.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.79
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene 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

CID 173126547
CID 173126547
1-chloro-4-(1,2-diphenylethenyl)benzene
CID 58695106
2-(2-chlorophenyl)-2-phenylethenamine
CID 174393832
2-(1,2-diphenylethenyl)benzaldehyde
CID 87999369
1-[(Z)-1,2-diphenylethenyl]naphthalene
CID 11347319
1-[2-[(E)-1,2-diphenylethenyl]phenyl]ethanone
CID 11380988
3-(2-chlorophenyl)-3-phenylprop-2-enal
CID 71369713
CID 172843956
CID 172843956
[2-[(E)-1,2-diphenylethenyl]phenyl]-diphenylphosphane
CID 132966210
1-[(Z)-1,2-diphenylethenyl]-4-[4-[(Z)-1,2-diphenylethenyl]phenyl]benzene
CID 173002469
2-[2-[(E)-1,2-diphenylethenyl]phenyl]propan-2-amine
CID 102527150
1-(1,2-diphenylethenyl)-4-phenylbenzene
CID 54005685

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene?
The IUPAC name of 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene (CID 175564265) is 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene.
What is the SMILES notation for 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene?
The canonical SMILES for 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene is Clc1ccccc1/C(=C/c1ccccc1)c1ccccc1.
What is the InChIKey of 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene?
The InChIKey is COVBDPUXLPXGFK-XDJHFCHBSA-N. The full InChI is InChI=1S/C20H15Cl/c21-20-14-8-7-13-18(20)19(17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-15H/b19-15+.
What are the key properties of 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene?
1-chloro-2-[(E)-1,2-diphenylethenyl]benzene has a molecular weight of 290.79 g/mol, XLogP of 5.93, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[(E)-1,2-diphenylethenyl]benzene is sourced from PubChem (CID 175564265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).