[(Z)-2-bromo-2-chloroethenyl]cyclohexane

C8H12BrCl — CID 12528610

IUPAC[(Z)-2-bromo-2-chloroethenyl]cyclohexane
SMILESCl/C(Br)=C/C1CCCCC1
InChIInChI=1S/C8H12BrCl/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2/b8-6+
InChIKeyIIHPYTKVEUSIMM-SOFGYWHQSA-N
MW223.54 g/mol
LogP4.04
Rot. Bonds1

About [(Z)-2-bromo-2-chloroethenyl]cyclohexane

[(Z)-2-bromo-2-chloroethenyl]cyclohexane (PubChem CID 12528610) has the molecular formula C8H12BrCl and a molecular weight of 223.54 g/mol. Its IUPAC name is [(Z)-2-bromo-2-chloroethenyl]cyclohexane.

Molecular Properties

Compound Name[(Z)-2-bromo-2-chloroethenyl]cyclohexane
PubChem CID12528610
Molecular FormulaC8H12BrCl
Molecular Weight223.54 g/mol
Exact Mass221.98
IUPAC Name[(Z)-2-bromo-2-chloroethenyl]cyclohexane
SMILESCl/C(Br)=C/C1CCCCC1
InChIInChI=1S/C8H12BrCl/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2/b8-6+
InChIKeyIIHPYTKVEUSIMM-SOFGYWHQSA-N
XLogP4.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.54
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [(Z)-2-bromo-2-chloroethenyl]cyclohexane?
The IUPAC name of [(Z)-2-bromo-2-chloroethenyl]cyclohexane (CID 12528610) is [(Z)-2-bromo-2-chloroethenyl]cyclohexane.
What is the SMILES notation for [(Z)-2-bromo-2-chloroethenyl]cyclohexane?
The canonical SMILES for [(Z)-2-bromo-2-chloroethenyl]cyclohexane is Cl/C(Br)=C/C1CCCCC1.
What is the InChIKey of [(Z)-2-bromo-2-chloroethenyl]cyclohexane?
The InChIKey is IIHPYTKVEUSIMM-SOFGYWHQSA-N. The full InChI is InChI=1S/C8H12BrCl/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2/b8-6+.
What are the key properties of [(Z)-2-bromo-2-chloroethenyl]cyclohexane?
[(Z)-2-bromo-2-chloroethenyl]cyclohexane has a molecular weight of 223.54 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-bromo-2-chloroethenyl]cyclohexane is sourced from PubChem (CID 12528610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).