4,4-difluorobut-3-enylcyclohexane

C10H16F2 — CID 57092135

IUPAC4,4-difluorobut-3-enylcyclohexane
SMILESFC(F)=CCCC1CCCCC1
InChIInChI=1S/C10H16F2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h8-9H,1-7H2
InChIKeyUXZVLMIEHYHZSC-UHFFFAOYSA-N
MW174.23 g/mol
LogP4.13
Rot. Bonds3

About 4,4-difluorobut-3-enylcyclohexane

4,4-difluorobut-3-enylcyclohexane (PubChem CID 57092135) has the molecular formula C10H16F2 and a molecular weight of 174.23 g/mol. Its IUPAC name is 4,4-difluorobut-3-enylcyclohexane.

Molecular Properties

Compound Name4,4-difluorobut-3-enylcyclohexane
PubChem CID57092135
Molecular FormulaC10H16F2
Molecular Weight174.23 g/mol
Exact Mass174.12
IUPAC Name4,4-difluorobut-3-enylcyclohexane
SMILESFC(F)=CCCC1CCCCC1
InChIInChI=1S/C10H16F2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h8-9H,1-7H2
InChIKeyUXZVLMIEHYHZSC-UHFFFAOYSA-N
XLogP4.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4,4-difluorobut-3-enylcyclohexane with MolForge

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

Launch Full Analysis

Related Compounds

1-Methylidene-4-(trifluoromethyl)cyclohexane
CID 12937208
4-Ethenyl-1,1-difluorocyclohexane
CID 123987847
2,2-Difluoroethenylcyclooctane
CID 14273009
(5,5-Difluoropenta-3,4-dien-1-yl)cyclohexane
CID 162623317
Penta-3,4-dienylcyclohexane
CID 11171075
(Trifluorovinyl)cyclohexane
CID 2778011
1,1,2,3,3-Pentafluoroprop-2-enylcyclohexane
CID 10774972
1-Cyclohexyl-4-(3,3-difluoroprop-2-enyl)cyclohexane
CID 19842781
1-(2,2-Difluoroethenyl)-4-propylcyclohexane
CID 19961267
2-(trans-4-n-Propylcyclohexyl)-1,1,2-trifluoroethylene
CID 19961268
1-Prop-2-enyl-4-(1,2,2-trifluoroethenyl)cyclohexane
CID 19961276
2,2-Difluoroethenylcyclohexane
CID 22182864

Frequently Asked Questions

What is the IUPAC name of 4,4-difluorobut-3-enylcyclohexane?
The IUPAC name of 4,4-difluorobut-3-enylcyclohexane (CID 57092135) is 4,4-difluorobut-3-enylcyclohexane.
What is the SMILES notation for 4,4-difluorobut-3-enylcyclohexane?
The canonical SMILES for 4,4-difluorobut-3-enylcyclohexane is FC(F)=CCCC1CCCCC1.
What is the InChIKey of 4,4-difluorobut-3-enylcyclohexane?
The InChIKey is UXZVLMIEHYHZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h8-9H,1-7H2.
What are the key properties of 4,4-difluorobut-3-enylcyclohexane?
4,4-difluorobut-3-enylcyclohexane has a molecular weight of 174.23 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluorobut-3-enylcyclohexane is sourced from PubChem (CID 57092135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).