2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene

C20H12F2O2S — CID 59266821

IUPAC2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene
SMILESO=S(=O)(c1ccc2cc(F)ccc2c1)c1ccc2cc(F)ccc2c1
InChIInChI=1S/C20H12F2O2S/c21-17-5-1-15-11-19(7-3-13(15)9-17)25(23,24)20-8-4-14-10-18(22)6-2-16(14)12-20/h1-12H
InChIKeyJVWCFNFVWXXOMF-UHFFFAOYSA-N
MW354.38 g/mol
LogP5.10
Rot. Bonds2

About 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene

2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene (PubChem CID 59266821) has the molecular formula C20H12F2O2S and a molecular weight of 354.38 g/mol. Its IUPAC name is 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene.

Molecular Properties

Compound Name2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene
PubChem CID59266821
Molecular FormulaC20H12F2O2S
Molecular Weight354.38 g/mol
Exact Mass354.05
IUPAC Name2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene
SMILESO=S(=O)(c1ccc2cc(F)ccc2c1)c1ccc2cc(F)ccc2c1
InChIInChI=1S/C20H12F2O2S/c21-17-5-1-15-11-19(7-3-13(15)9-17)25(23,24)20-8-4-14-10-18(22)6-2-16(14)12-20/h1-12H
InChIKeyJVWCFNFVWXXOMF-UHFFFAOYSA-N
XLogP5.10
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.38
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(2,5-difluorophenyl)naphthalene-2-sulfonamide
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CID 54331291
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6-(2-oxochromen-6-yl)sulfonylchromen-2-one
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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene?
The IUPAC name of 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene (CID 59266821) is 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene.
What is the SMILES notation for 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene?
The canonical SMILES for 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene is O=S(=O)(c1ccc2cc(F)ccc2c1)c1ccc2cc(F)ccc2c1.
What is the InChIKey of 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene?
The InChIKey is JVWCFNFVWXXOMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12F2O2S/c21-17-5-1-15-11-19(7-3-13(15)9-17)25(23,24)20-8-4-14-10-18(22)6-2-16(14)12-20/h1-12H.
What are the key properties of 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene?
2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene has a molecular weight of 354.38 g/mol, XLogP of 5.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(6-fluoronaphthalen-2-yl)sulfonylnaphthalene is sourced from PubChem (CID 59266821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).