4-fluoro-2-(2-fluorophenyl)-1-methylbenzene

C13H10F2 — CID 46313938

IUPAC4-fluoro-2-(2-fluorophenyl)-1-methylbenzene
SMILESCc1ccc(F)cc1-c1ccccc1F
InChIInChI=1S/C13H10F2/c1-9-6-7-10(14)8-12(9)11-4-2-3-5-13(11)15/h2-8H,1H3
InChIKeySGVIDMFCSRYBON-UHFFFAOYSA-N
MW204.22 g/mol
LogP3.94
Rot. Bonds1

About 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene

4-fluoro-2-(2-fluorophenyl)-1-methylbenzene (PubChem CID 46313938) has the molecular formula C13H10F2 and a molecular weight of 204.22 g/mol. Its IUPAC name is 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene.

Molecular Properties

Compound Name4-fluoro-2-(2-fluorophenyl)-1-methylbenzene
PubChem CID46313938
Molecular FormulaC13H10F2
Molecular Weight204.22 g/mol
Exact Mass204.08
IUPAC Name4-fluoro-2-(2-fluorophenyl)-1-methylbenzene
SMILESCc1ccc(F)cc1-c1ccccc1F
InChIInChI=1S/C13H10F2/c1-9-6-7-10(14)8-12(9)11-4-2-3-5-13(11)15/h2-8H,1H3
InChIKeySGVIDMFCSRYBON-UHFFFAOYSA-N
XLogP3.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(2-fluorophenyl)-1,4-dimethylbenzene
CID 66641436
4-fluoro-1-methyl-2-phenylbenzene
CID 21350138
2-(5-chloro-2-methylphenyl)-4-fluoro-1-methylbenzene
CID 129059245
ethane;4-fluoro-1-(5-fluoro-2-methylphenyl)-2-methylbenzene
CID 143449254
1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
CID 105408607
1,4-dichloro-2-(5-fluoro-2-methylphenyl)benzene
CID 118990356
N-[[3-(2-fluorophenyl)-4-methylphenyl]methyl]propan-2-amine
CID 105408608
2-(5-fluoro-2-methylphenyl)-6-methoxyphenol
CID 83128791
2-fluoro-1-(2-fluorophenyl)-4-methylbenzene
CID 46313956
4-fluoro-2-(2-fluorophenyl)benzoic acid
CID 46312310
N-ethyl-1-[2-(5-fluoro-2-methylphenyl)phenyl]ethanamine
CID 54911658
1-[4-fluoro-3-(5-fluoro-2-methylphenyl)phenyl]-N-methylmethanamine
CID 54911947

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene?
The IUPAC name of 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene (CID 46313938) is 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene.
What is the SMILES notation for 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene?
The canonical SMILES for 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene is Cc1ccc(F)cc1-c1ccccc1F.
What is the InChIKey of 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene?
The InChIKey is SGVIDMFCSRYBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2/c1-9-6-7-10(14)8-12(9)11-4-2-3-5-13(11)15/h2-8H,1H3.
What are the key properties of 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene?
4-fluoro-2-(2-fluorophenyl)-1-methylbenzene has a molecular weight of 204.22 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(2-fluorophenyl)-1-methylbenzene is sourced from PubChem (CID 46313938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).