1-fluoro-4-methylbenzene;methane

C8H11F — CID 158431518

IUPAC1-fluoro-4-methylbenzene;methane
SMILESC.Cc1ccc(F)cc1
InChIInChI=1S/C7H7F.CH4/c1-6-2-4-7(8)5-3-6;/h2-5H,1H3;1H4
InChIKeyHBSDSRXDBJVIIR-UHFFFAOYSA-N
MW126.17 g/mol
LogP2.77
Rot. Bonds

About 1-fluoro-4-methylbenzene;methane

1-fluoro-4-methylbenzene;methane (PubChem CID 158431518) has the molecular formula C8H11F and a molecular weight of 126.17 g/mol. Its IUPAC name is 1-fluoro-4-methylbenzene;methane.

Molecular Properties

Compound Name1-fluoro-4-methylbenzene;methane
PubChem CID158431518
Molecular FormulaC8H11F
Molecular Weight126.17 g/mol
Exact Mass126.08
IUPAC Name1-fluoro-4-methylbenzene;methane
SMILESC.Cc1ccc(F)cc1
InChIInChI=1S/C7H7F.CH4/c1-6-2-4-7(8)5-3-6;/h2-5H,1H3;1H4
InChIKeyHBSDSRXDBJVIIR-UHFFFAOYSA-N
XLogP2.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.17
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

chromium;1-fluoro-4-methylbenzene
CID 139244082
methane;pentakis(1,4-xylene)
CID 160760083
1-fluoro-4-methylbenzene;1-fluoro-4-[2-(4-methylphenyl)ethyl]benzene
CID 144561335
1-fluoro-4-[3-(4-methylphenyl)phenyl]benzene
CID 23629230
2-fluoro-1,4-dimethylbenzene;1-fluoro-4-methylbenzene
CID 159574523
chloro-(4-fluorophenyl)-(4-methylphenyl)phosphane
CID 175598108
1-fluoro-4-[4-(4-methylphenyl)buta-1,3-diynyl]benzene
CID 20700580
1-(4-fluorophenyl)-1-(4-methylphenyl)ethanamine
CID 60799030
1-fluoro-4-[2-methyl-1-(4-methylphenyl)propyl]benzene
CID 21336384
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
1-fluoro-4-methylbenzene;N-methyl-N-propylpropan-1-amine
CID 143556008
platinum;1,4-xylene
CID 173034643

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-methylbenzene;methane?
The IUPAC name of 1-fluoro-4-methylbenzene;methane (CID 158431518) is 1-fluoro-4-methylbenzene;methane.
What is the SMILES notation for 1-fluoro-4-methylbenzene;methane?
The canonical SMILES for 1-fluoro-4-methylbenzene;methane is C.Cc1ccc(F)cc1.
What is the InChIKey of 1-fluoro-4-methylbenzene;methane?
The InChIKey is HBSDSRXDBJVIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F.CH4/c1-6-2-4-7(8)5-3-6;/h2-5H,1H3;1H4.
What are the key properties of 1-fluoro-4-methylbenzene;methane?
1-fluoro-4-methylbenzene;methane has a molecular weight of 126.17 g/mol, XLogP of 2.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-methylbenzene;methane is sourced from PubChem (CID 158431518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).