[(E)-2-bromoethenyl]cyclohexane

C8H13Br — CID 5382610

IUPAC[(E)-2-bromoethenyl]cyclohexane
SMILESBr/C=C/C1CCCCC1
InChIInChI=1S/C8H13Br/c9-7-6-8-4-2-1-3-5-8/h6-8H,1-5H2/b7-6+
InChIKeyBMFWWXHEKBIRMY-VOTSOKGWSA-N
MW189.10 g/mol
LogP3.48
Rot. Bonds1

About [(E)-2-bromoethenyl]cyclohexane

[(E)-2-bromoethenyl]cyclohexane (PubChem CID 5382610) has the molecular formula C8H13Br and a molecular weight of 189.10 g/mol. Its IUPAC name is [(E)-2-bromoethenyl]cyclohexane.

Molecular Properties

Compound Name[(E)-2-bromoethenyl]cyclohexane
PubChem CID5382610
Molecular FormulaC8H13Br
Molecular Weight189.10 g/mol
Exact Mass188.02
IUPAC Name[(E)-2-bromoethenyl]cyclohexane
SMILESBr/C=C/C1CCCCC1
InChIInChI=1S/C8H13Br/c9-7-6-8-4-2-1-3-5-8/h6-8H,1-5H2/b7-6+
InChIKeyBMFWWXHEKBIRMY-VOTSOKGWSA-N
XLogP3.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.10
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze [(E)-2-bromoethenyl]cyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(E)-2-bromoethenyl]cyclohexane?
The IUPAC name of [(E)-2-bromoethenyl]cyclohexane (CID 5382610) is [(E)-2-bromoethenyl]cyclohexane.
What is the SMILES notation for [(E)-2-bromoethenyl]cyclohexane?
The canonical SMILES for [(E)-2-bromoethenyl]cyclohexane is Br/C=C/C1CCCCC1.
What is the InChIKey of [(E)-2-bromoethenyl]cyclohexane?
The InChIKey is BMFWWXHEKBIRMY-VOTSOKGWSA-N. The full InChI is InChI=1S/C8H13Br/c9-7-6-8-4-2-1-3-5-8/h6-8H,1-5H2/b7-6+.
What are the key properties of [(E)-2-bromoethenyl]cyclohexane?
[(E)-2-bromoethenyl]cyclohexane has a molecular weight of 189.10 g/mol, XLogP of 3.48, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-bromoethenyl]cyclohexane is sourced from PubChem (CID 5382610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).