3-ethenyl-1-fluoro-7-methylnaphthalene

C13H11F — CID 58718822

IUPAC3-ethenyl-1-fluoro-7-methylnaphthalene
SMILESC=Cc1cc(F)c2cc(C)ccc2c1
InChIInChI=1S/C13H11F/c1-3-10-7-11-5-4-9(2)6-12(11)13(14)8-10/h3-8H,1H2,2H3
InChIKeyHSOQCEPLHUQOCA-UHFFFAOYSA-N
MW186.23 g/mol
LogP3.93
Rot. Bonds1

About 3-ethenyl-1-fluoro-7-methylnaphthalene

3-ethenyl-1-fluoro-7-methylnaphthalene (PubChem CID 58718822) has the molecular formula C13H11F and a molecular weight of 186.23 g/mol. Its IUPAC name is 3-ethenyl-1-fluoro-7-methylnaphthalene.

Molecular Properties

Compound Name3-ethenyl-1-fluoro-7-methylnaphthalene
PubChem CID58718822
Molecular FormulaC13H11F
Molecular Weight186.23 g/mol
Exact Mass186.08
IUPAC Name3-ethenyl-1-fluoro-7-methylnaphthalene
SMILESC=Cc1cc(F)c2cc(C)ccc2c1
InChIInChI=1S/C13H11F/c1-3-10-7-11-5-4-9(2)6-12(11)13(14)8-10/h3-8H,1H2,2H3
InChIKeyHSOQCEPLHUQOCA-UHFFFAOYSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-bis(ethenyl)-7-methylnaphthalene
CID 59335501
azane;1-fluoro-7-methylnaphthalene
CID 174703926
2-ethenyl-3-fluoro-6-methylnaphthalene
CID 58718953
4-ethenyl-2-fluoro-1-methylbenzene
CID 20708999
2-ethenyl-1,7-dimethylnaphthalene
CID 142881924
2,9-dimethylnaphtho[1,2-b]phenanthrene
CID 58426646
3-[2-(2,6-difluoro-4-methylphenyl)ethyl]-1-fluoro-7-methylnaphthalene
CID 166874449
1,3-bis(ethenyl)-5-methylbenzene;1-ethenyl-4-methylbenzene
CID 158777597
7-chloro-1-fluoro-3-methylnaphthalene
CID 58839538
ethane;1-ethenyl-2-ethyl-7-methylnaphthalene
CID 142614708
6-[2-(4-ethenyl-2,6-difluorophenyl)ethynyl]-1,2-difluoronaphthalene
CID 139846771
2-ethenyl-6-methyl-1-benzofuran
CID 142567600

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-1-fluoro-7-methylnaphthalene?
The IUPAC name of 3-ethenyl-1-fluoro-7-methylnaphthalene (CID 58718822) is 3-ethenyl-1-fluoro-7-methylnaphthalene.
What is the SMILES notation for 3-ethenyl-1-fluoro-7-methylnaphthalene?
The canonical SMILES for 3-ethenyl-1-fluoro-7-methylnaphthalene is C=Cc1cc(F)c2cc(C)ccc2c1.
What is the InChIKey of 3-ethenyl-1-fluoro-7-methylnaphthalene?
The InChIKey is HSOQCEPLHUQOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F/c1-3-10-7-11-5-4-9(2)6-12(11)13(14)8-10/h3-8H,1H2,2H3.
What are the key properties of 3-ethenyl-1-fluoro-7-methylnaphthalene?
3-ethenyl-1-fluoro-7-methylnaphthalene has a molecular weight of 186.23 g/mol, XLogP of 3.93, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-1-fluoro-7-methylnaphthalene is sourced from PubChem (CID 58718822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).