1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene

C15H18F2 — CID 90893098

IUPAC1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene
SMILESC=Cc1ccc(C2CCC(C)CC2)c(F)c1F
InChIInChI=1S/C15H18F2/c1-3-11-8-9-13(15(17)14(11)16)12-6-4-10(2)5-7-12/h3,8-10,12H,1,4-7H2,2H3
InChIKeyDXJICHXKUCEFAZ-UHFFFAOYSA-N
MW236.31 g/mol
LogP4.90
Rot. Bonds2

About 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene

1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene (PubChem CID 90893098) has the molecular formula C15H18F2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene.

Molecular Properties

Compound Name1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene
PubChem CID90893098
Molecular FormulaC15H18F2
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene
SMILESC=Cc1ccc(C2CCC(C)CC2)c(F)c1F
InChIInChI=1S/C15H18F2/c1-3-11-8-9-13(15(17)14(11)16)12-6-4-10(2)5-7-12/h3,8-10,12H,1,4-7H2,2H3
InChIKeyDXJICHXKUCEFAZ-UHFFFAOYSA-N
XLogP4.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethenoxy-2,3-difluoro-4-(4-methylcyclohexyl)benzene
CID 20645953
1-ethenoxy-2,3-difluoro-4-(4-methylcyclohexyl)benzene;molecular hydrogen
CID 160793122
4-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]cyclohexan-1-one
CID 143909524
1-ethenyl-4-[(E)-2-[4-(4-ethoxy-2,3-difluorophenyl)cyclohexyl]ethenyl]-2,3-difluorobenzene
CID 58140557
1-cyclohexyl-4-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluorobenzene
CID 123193777
2,3-difluoro-1-[4-(4-methylcyclohexyl)cyclohexyl]-4-prop-2-enylbenzene;molecular hydrogen
CID 159485452
2,3-difluoro-1-methoxy-4-(4-methylcyclohexyl)benzene;ethane
CID 142351768
[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-(4-methylcyclohexyl)methanol
CID 134358796
1-[4-(4-ethenyl-3-fluorophenyl)cyclohexyl]-2,3-difluoro-4-methoxybenzene
CID 88997617
1-(4-but-3-enylphenyl)-2,3-difluoro-4-(4-methylcyclohexyl)benzene
CID 139749327
5-[4-[4-[2-(4-ethenyl-2,3-difluorophenyl)ethyl]-2,3-difluorophenyl]-2,3-difluorophenyl]-2-propyloxane
CID 58535303
[2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]phenyl] hypochlorite
CID 143863856

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene?
The IUPAC name of 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene (CID 90893098) is 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene.
What is the SMILES notation for 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene?
The canonical SMILES for 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene is C=Cc1ccc(C2CCC(C)CC2)c(F)c1F.
What is the InChIKey of 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene?
The InChIKey is DXJICHXKUCEFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2/c1-3-11-8-9-13(15(17)14(11)16)12-6-4-10(2)5-7-12/h3,8-10,12H,1,4-7H2,2H3.
What are the key properties of 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene?
1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene has a molecular weight of 236.31 g/mol, XLogP of 4.90, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,3-difluoro-4-(4-methylcyclohexyl)benzene is sourced from PubChem (CID 90893098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).