2,4-dichloro-1-(2-chloroethenyl)benzene

C8H5Cl3 — CID 609851

IUPAC2,4-dichloro-1-(2-chloroethenyl)benzene
SMILESClC=Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H5Cl3/c9-4-3-6-1-2-7(10)5-8(6)11/h1-5H
InChIKeyXWEMGFGRWJFXST-UHFFFAOYSA-N
MW207.49 g/mol
LogP4.20
Rot. Bonds1

About 2,4-dichloro-1-(2-chloroethenyl)benzene

2,4-dichloro-1-(2-chloroethenyl)benzene (PubChem CID 609851) has the molecular formula C8H5Cl3 and a molecular weight of 207.49 g/mol. Its IUPAC name is 2,4-dichloro-1-(2-chloroethenyl)benzene.

Molecular Properties

Compound Name2,4-dichloro-1-(2-chloroethenyl)benzene
PubChem CID609851
Molecular FormulaC8H5Cl3
Molecular Weight207.49 g/mol
Exact Mass205.95
IUPAC Name2,4-dichloro-1-(2-chloroethenyl)benzene
SMILESClC=Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H5Cl3/c9-4-3-6-1-2-7(10)5-8(6)11/h1-5H
InChIKeyXWEMGFGRWJFXST-UHFFFAOYSA-N
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.49
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-dichloro-1-[2-[2-(2,4-dichlorophenyl)ethenoxy]ethenyl]benzene
CID 139944429
3-(2,4-dichlorophenyl)prop-2-enal
CID 4193011
1-[(Z)-but-1-enyl]-2,4-dichlorobenzene
CID 67080245
2,4-dichloro-1-(2-phenylethenyl)benzene
CID 66779322
(E)-4-(2,4-dichlorophenyl)but-3-enal
CID 87333771
2,4-dichloro-1-(2,2-difluoroethenyl)benzene
CID 101499085
1-[(E)-6-bromohex-1-enyl]-2,4-dichlorobenzene
CID 10638478
(E)-6-(2,4-dichlorophenyl)hex-5-ene-1-thiol
CID 10563343
3-(2,4-dichlorophenyl)prop-2-enyl formate
CID 90884165
1-(2,4-dichlorophenyl)pent-1-en-3-one
CID 142778018
3-(2,4-dichlorophenyl)-N-[3-[3-(2,4-dichlorophenyl)prop-2-enoylamino]phenyl]prop-2-enamide
CID 3487324
2,4-dichloro-1-[(1E,3Z)-4-chloro-4-phenylbuta-1,3-dienyl]benzene
CID 10686344

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-1-(2-chloroethenyl)benzene?
The IUPAC name of 2,4-dichloro-1-(2-chloroethenyl)benzene (CID 609851) is 2,4-dichloro-1-(2-chloroethenyl)benzene.
What is the SMILES notation for 2,4-dichloro-1-(2-chloroethenyl)benzene?
The canonical SMILES for 2,4-dichloro-1-(2-chloroethenyl)benzene is ClC=Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-1-(2-chloroethenyl)benzene?
The InChIKey is XWEMGFGRWJFXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Cl3/c9-4-3-6-1-2-7(10)5-8(6)11/h1-5H.
What are the key properties of 2,4-dichloro-1-(2-chloroethenyl)benzene?
2,4-dichloro-1-(2-chloroethenyl)benzene has a molecular weight of 207.49 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-1-(2-chloroethenyl)benzene is sourced from PubChem (CID 609851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).