1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene

C15H12Cl2 — CID 129289672

IUPAC1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene
SMILESCc1ccc(/C=C\c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H12Cl2/c1-11-2-4-12(5-3-11)6-7-13-8-9-14(16)15(17)10-13/h2-10H,1H3/b7-6-
InChIKeyUVAQXNACTBHPAN-SREVYHEPSA-N
MW263.17 g/mol
LogP5.47
Rot. Bonds2

About 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene

1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene (PubChem CID 129289672) has the molecular formula C15H12Cl2 and a molecular weight of 263.17 g/mol. Its IUPAC name is 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene.

Molecular Properties

Compound Name1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene
PubChem CID129289672
Molecular FormulaC15H12Cl2
Molecular Weight263.17 g/mol
Exact Mass262.03
IUPAC Name1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene
SMILESCc1ccc(/C=C\c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H12Cl2/c1-11-2-4-12(5-3-11)6-7-13-8-9-14(16)15(17)10-13/h2-10H,1H3/b7-6-
InChIKeyUVAQXNACTBHPAN-SREVYHEPSA-N
XLogP5.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.17
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene?
The IUPAC name of 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene (CID 129289672) is 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene.
What is the SMILES notation for 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene?
The canonical SMILES for 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene is Cc1ccc(/C=C\c2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene?
The InChIKey is UVAQXNACTBHPAN-SREVYHEPSA-N. The full InChI is InChI=1S/C15H12Cl2/c1-11-2-4-12(5-3-11)6-7-13-8-9-14(16)15(17)10-13/h2-10H,1H3/b7-6-.
What are the key properties of 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene?
1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene has a molecular weight of 263.17 g/mol, XLogP of 5.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dichloro-4-[(Z)-2-(4-methylphenyl)ethenyl]benzene is sourced from PubChem (CID 129289672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).