2-(2-bromo-2-fluoroethenyl)naphthalene

C12H8BrF — CID 71421108

IUPAC2-(2-bromo-2-fluoroethenyl)naphthalene
SMILESFC(Br)=Cc1ccc2ccccc2c1
InChIInChI=1S/C12H8BrF/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H
InChIKeyGNOAVGPFXABJNI-UHFFFAOYSA-N
MW251.10 g/mol
LogP4.50
Rot. Bonds1

About 2-(2-bromo-2-fluoroethenyl)naphthalene

2-(2-bromo-2-fluoroethenyl)naphthalene (PubChem CID 71421108) has the molecular formula C12H8BrF and a molecular weight of 251.10 g/mol. Its IUPAC name is 2-(2-bromo-2-fluoroethenyl)naphthalene.

Molecular Properties

Compound Name2-(2-bromo-2-fluoroethenyl)naphthalene
PubChem CID71421108
Molecular FormulaC12H8BrF
Molecular Weight251.10 g/mol
Exact Mass249.98
IUPAC Name2-(2-bromo-2-fluoroethenyl)naphthalene
SMILESFC(Br)=Cc1ccc2ccccc2c1
InChIInChI=1S/C12H8BrF/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H
InChIKeyGNOAVGPFXABJNI-UHFFFAOYSA-N
XLogP4.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.10
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[(E)-2-fluorobut-1-en-3-ynyl]naphthalene
CID 71504862
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CID 101475469
(E)-1-naphthalen-2-ylprop-1-en-2-amine
CID 20741960
2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
(Z)-2-fluoro-3-naphthalen-2-yl-1-phenylprop-2-en-1-ol
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2-(1-fluoro-2-naphthalen-2-ylethenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 171111326
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
2-naphthalen-2-ylethenol
CID 67195423
2-(2,2-diphenylethenyl)-6-[2-[6-(2-naphthalen-2-ylethenyl)naphthalen-2-yl]ethenyl]naphthalene
CID 72565680
2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene
CID 135028024
(E)-3-methyl-4-naphthalen-2-ylbut-3-en-2-amine
CID 103091933
2-(2,2-diphenylethenyl)anthracene
CID 155667641

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-2-fluoroethenyl)naphthalene?
The IUPAC name of 2-(2-bromo-2-fluoroethenyl)naphthalene (CID 71421108) is 2-(2-bromo-2-fluoroethenyl)naphthalene.
What is the SMILES notation for 2-(2-bromo-2-fluoroethenyl)naphthalene?
The canonical SMILES for 2-(2-bromo-2-fluoroethenyl)naphthalene is FC(Br)=Cc1ccc2ccccc2c1.
What is the InChIKey of 2-(2-bromo-2-fluoroethenyl)naphthalene?
The InChIKey is GNOAVGPFXABJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrF/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H.
What are the key properties of 2-(2-bromo-2-fluoroethenyl)naphthalene?
2-(2-bromo-2-fluoroethenyl)naphthalene has a molecular weight of 251.10 g/mol, XLogP of 4.50, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-2-fluoroethenyl)naphthalene is sourced from PubChem (CID 71421108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).