1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane

C15H24F2 — CID 143901343

IUPAC1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane
SMILESC/C=C(C(\F)=C(/C)F)/C1CCC(CCC)CC1
InChIInChI=1S/C15H24F2/c1-4-6-12-7-9-13(10-8-12)14(5-2)15(17)11(3)16/h5,12-13H,4,6-10H2,1-3H3/b14-5-,15-11-
InChIKeyOJJUDBOVVORTDS-RJSUYGKXSA-N
MW242.35 g/mol
LogP5.71
Rot. Bonds4

About 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane

1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane (PubChem CID 143901343) has the molecular formula C15H24F2 and a molecular weight of 242.35 g/mol. Its IUPAC name is 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane.

Molecular Properties

Compound Name1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane
PubChem CID143901343
Molecular FormulaC15H24F2
Molecular Weight242.35 g/mol
Exact Mass242.18
IUPAC Name1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane
SMILESC/C=C(C(\F)=C(/C)F)/C1CCC(CCC)CC1
InChIInChI=1S/C15H24F2/c1-4-6-12-7-9-13(10-8-12)14(5-2)15(17)11(3)16/h5,12-13H,4,6-10H2,1-3H3/b14-5-,15-11-
InChIKeyOJJUDBOVVORTDS-RJSUYGKXSA-N
XLogP5.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.35
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-propyl-4-[4-(4-propylcyclohexyl)pent-3-enyl]cyclohexane
CID 54061111
1-methyl-4-[(Z)-4-(4-propylcyclohexyl)pent-3-enyl]cyclohexane
CID 173321092
1-butyl-4-[(Z)-3-(4-propylcyclohexyl)but-2-en-2-yl]cyclohexane
CID 173321261
[1,2-difluoro-2-(4-propylcyclohexyl)ethenyl]-trimethylsilane
CID 54125156
1-pent-3-enyl-4-propylcyclohexane
CID 72599468
ethane;propane;propylcyclopropane
CID 145406182
1-propyl-4-[1-[4-(4-propylcyclohexyl)cyclohexyl]prop-1-en-2-yl]cyclohexane
CID 54147269
1-(1,2,3,3,3-pentafluoroprop-1-enyl)-4-(4-propylcyclohexyl)cyclohexane
CID 74060332
1-[(E)-2-bromo-2-fluoroethenyl]-4-propylcyclohexane
CID 58526771
1-[(Z)-1-pentoxyprop-1-enyl]-4-propylcyclohexane
CID 140668560
1-(2,2-difluoroethenyl)-4-[(E)-2-(4-propylcyclohexyl)ethenyl]cyclohexane
CID 22011587
1,4-dipropylcyclohexane;pentane
CID 90867354

Frequently Asked Questions

What is the IUPAC name of 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane?
The IUPAC name of 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane (CID 143901343) is 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane.
What is the SMILES notation for 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane?
The canonical SMILES for 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane is C/C=C(C(\F)=C(/C)F)/C1CCC(CCC)CC1.
What is the InChIKey of 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane?
The InChIKey is OJJUDBOVVORTDS-RJSUYGKXSA-N. The full InChI is InChI=1S/C15H24F2/c1-4-6-12-7-9-13(10-8-12)14(5-2)15(17)11(3)16/h5,12-13H,4,6-10H2,1-3H3/b14-5-,15-11-.
What are the key properties of 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane?
1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane has a molecular weight of 242.35 g/mol, XLogP of 5.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2Z,4Z)-4,5-difluorohexa-2,4-dien-3-yl]-4-propylcyclohexane is sourced from PubChem (CID 143901343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).