6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene

C24H16F4 — CID 139846760

IUPAC6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene
SMILESCCc1ccc(-c2ccc(-c3ccc4cc(F)c(F)cc4c3)c(F)c2)c(F)c1
InChIInChI=1S/C24H16F4/c1-2-14-3-7-19(21(25)9-14)17-6-8-20(22(26)12-17)16-5-4-15-11-23(27)24(28)13-18(15)10-16/h3-13H,2H2,1H3
InChIKeySEWYANGBBZKIEZ-UHFFFAOYSA-N
MW380.38 g/mol
LogP7.29
Rot. Bonds3

About 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene

6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene (PubChem CID 139846760) has the molecular formula C24H16F4 and a molecular weight of 380.38 g/mol. Its IUPAC name is 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene.

Molecular Properties

Compound Name6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene
PubChem CID139846760
Molecular FormulaC24H16F4
Molecular Weight380.38 g/mol
Exact Mass380.12
IUPAC Name6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene
SMILESCCc1ccc(-c2ccc(-c3ccc4cc(F)c(F)cc4c3)c(F)c2)c(F)c1
InChIInChI=1S/C24H16F4/c1-2-14-3-7-19(21(25)9-14)17-6-8-20(22(26)12-17)16-5-4-15-11-23(27)24(28)13-18(15)10-16/h3-13H,2H2,1H3
InChIKeySEWYANGBBZKIEZ-UHFFFAOYSA-N
XLogP7.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.38
LogP ≤ 57.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-(4-ethyl-2-fluorophenyl)-2,3-difluoronaphthalene
CID 139846935
6-[2-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]ethynyl]-2,3-difluoronaphthalene
CID 139846670
2,3-difluoro-6-(2-fluoro-4-hexylphenyl)naphthalene
CID 139847283
4-ethyl-1-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene
CID 129263989
4-ethyl-2-fluoro-1-(4-methoxyphenyl)benzene
CID 146522341
6-[4-(2,6-difluoro-4-pentylphenyl)-2-fluorophenyl]-2,3-difluoronaphthalene
CID 139847069
2,3-difluoro-6-(2-fluoro-4-methylphenyl)naphthalene
CID 139847087
6-[2,6-difluoro-4-(2-fluoro-4-heptylphenyl)phenyl]-2,3-difluoronaphthalene
CID 139846711
6-[4-(4-ethyl-2,6-difluorophenyl)-2-fluorophenyl]-1,2,3-trifluoronaphthalene
CID 139847159
1-(4-ethylphenyl)-2-fluoro-4-(2-fluoro-4-methylphenyl)benzene
CID 169027138
1,4-bis(4-ethylphenyl)benzene;1,4-bis(4-ethylphenyl)-2-fluorobenzene;1-ethyl-4-(4-ethyl-2-methylphenyl)-2-methylbenzene;1-ethyl-4-(4-ethyl-3-methylphenyl)-2-methylbenzene;4-ethyl-1-(4-ethyl-2-methylphenyl)-2-methylbenzene;1-ethyl-4-(4-ethylphenyl)-2-methylbenzene;4-ethyl-1-(4-ethylphenyl)-2-methylbenzene;2-ethyl-6-(4-ethylphenyl)naphthalene;1-ethyl-4-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene;4-ethyl-1-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene
CID 157191184
2,3-difluoro-6-[2-fluoro-4-[2-(2-fluoro-4-propylphenyl)ethynyl]phenyl]naphthalene
CID 139846966

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene?
The IUPAC name of 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene (CID 139846760) is 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene.
What is the SMILES notation for 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene?
The canonical SMILES for 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene is CCc1ccc(-c2ccc(-c3ccc4cc(F)c(F)cc4c3)c(F)c2)c(F)c1.
What is the InChIKey of 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene?
The InChIKey is SEWYANGBBZKIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16F4/c1-2-14-3-7-19(21(25)9-14)17-6-8-20(22(26)12-17)16-5-4-15-11-23(27)24(28)13-18(15)10-16/h3-13H,2H2,1H3.
What are the key properties of 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene?
6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene has a molecular weight of 380.38 g/mol, XLogP of 7.29, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-ethyl-2-fluorophenyl)-2-fluorophenyl]-2,3-difluoronaphthalene is sourced from PubChem (CID 139846760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).