2-fluoro-4-methyl-1-(3-methylphenyl)benzene

C14H13F — CID 142157742

IUPAC2-fluoro-4-methyl-1-(3-methylphenyl)benzene
SMILESCc1cccc(-c2ccc(C)cc2F)c1
InChIInChI=1S/C14H13F/c1-10-4-3-5-12(8-10)13-7-6-11(2)9-14(13)15/h3-9H,1-2H3
InChIKeyJJHODWYEKWZUDR-UHFFFAOYSA-N
MW200.26 g/mol
LogP4.11
Rot. Bonds1

About 2-fluoro-4-methyl-1-(3-methylphenyl)benzene

2-fluoro-4-methyl-1-(3-methylphenyl)benzene (PubChem CID 142157742) has the molecular formula C14H13F and a molecular weight of 200.26 g/mol. Its IUPAC name is 2-fluoro-4-methyl-1-(3-methylphenyl)benzene.

Molecular Properties

Compound Name2-fluoro-4-methyl-1-(3-methylphenyl)benzene
PubChem CID142157742
Molecular FormulaC14H13F
Molecular Weight200.26 g/mol
Exact Mass200.10
IUPAC Name2-fluoro-4-methyl-1-(3-methylphenyl)benzene
SMILESCc1cccc(-c2ccc(C)cc2F)c1
InChIInChI=1S/C14H13F/c1-10-4-3-5-12(8-10)13-7-6-11(2)9-14(13)15/h3-9H,1-2H3
InChIKeyJJHODWYEKWZUDR-UHFFFAOYSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine
CID 110282368
2,4-difluoro-5-(3-methylphenyl)aniline
CID 164576434
N-[[3-fluoro-4-(3-methylphenyl)phenyl]methyl]ethanamine
CID 81447039
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
5-(2-fluoro-4-methylphenyl)-1,2,3-trimethylbenzene
CID 20683371
1,3-bis(2-fluorophenyl)-5-(3-methylphenyl)benzene
CID 134391839
2-fluoro-4-(2-fluoro-4-methylphenyl)phenol
CID 53219309
2,3-difluoro-6-(2-fluoro-4-methylphenyl)naphthalene
CID 139847087
2-fluoro-1-(2-fluorophenyl)-4-methylbenzene
CID 46313956
N-[[3-fluoro-4-(3-methylphenyl)phenyl]methyl]propan-1-amine
CID 81447432
2-bromo-4-fluoro-1-(3-methylphenyl)benzene
CID 91110930
2-fluoro-1-[3-fluoro-4-(4-methylphenyl)phenyl]-4-(4-methylphenyl)benzene;methane
CID 161341950

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-1-(3-methylphenyl)benzene?
The IUPAC name of 2-fluoro-4-methyl-1-(3-methylphenyl)benzene (CID 142157742) is 2-fluoro-4-methyl-1-(3-methylphenyl)benzene.
What is the SMILES notation for 2-fluoro-4-methyl-1-(3-methylphenyl)benzene?
The canonical SMILES for 2-fluoro-4-methyl-1-(3-methylphenyl)benzene is Cc1cccc(-c2ccc(C)cc2F)c1.
What is the InChIKey of 2-fluoro-4-methyl-1-(3-methylphenyl)benzene?
The InChIKey is JJHODWYEKWZUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F/c1-10-4-3-5-12(8-10)13-7-6-11(2)9-14(13)15/h3-9H,1-2H3.
What are the key properties of 2-fluoro-4-methyl-1-(3-methylphenyl)benzene?
2-fluoro-4-methyl-1-(3-methylphenyl)benzene has a molecular weight of 200.26 g/mol, XLogP of 4.11, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-1-(3-methylphenyl)benzene is sourced from PubChem (CID 142157742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).