1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene

C14H8Cl4 — CID 3035

IUPAC1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
SMILESClC(Cl)=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H
InChIKeyUCNVFOCBFJOQAL-UHFFFAOYSA-N
MW318.03 g/mol
LogP6.19
Rot. Bonds2

About 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene

1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene (PubChem CID 3035) has the molecular formula C14H8Cl4 and a molecular weight of 318.03 g/mol. Its IUPAC name is 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene.

Molecular Properties

Compound Name1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
PubChem CID3035
Molecular FormulaC14H8Cl4
Molecular Weight318.03 g/mol
Exact Mass315.94
IUPAC Name1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
SMILESClC(Cl)=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H
InChIKeyUCNVFOCBFJOQAL-UHFFFAOYSA-N
XLogP6.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.03
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene?
The IUPAC name of 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene (CID 3035) is 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene.
What is the SMILES notation for 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene?
The canonical SMILES for 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene is ClC(Cl)=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1.
What is the InChIKey of 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene?
The InChIKey is UCNVFOCBFJOQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H.
What are the key properties of 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene?
1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene has a molecular weight of 318.03 g/mol, XLogP of 6.19, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene is sourced from PubChem (CID 3035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).