1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene

C19H12ClF3 — CID 54264737

IUPAC1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene
SMILESCc1cc(-c2ccc(-c3ccccc3F)c(F)c2F)ccc1Cl
InChIInChI=1S/C19H12ClF3/c1-11-10-12(6-9-16(11)20)13-7-8-15(19(23)18(13)22)14-4-2-3-5-17(14)21/h2-10H,1H3
InChIKeyDAUKMOSUMAARRF-UHFFFAOYSA-N
MW332.75 g/mol
LogP6.40
Rot. Bonds2

About 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene

1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene (PubChem CID 54264737) has the molecular formula C19H12ClF3 and a molecular weight of 332.75 g/mol. Its IUPAC name is 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene.

Molecular Properties

Compound Name1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene
PubChem CID54264737
Molecular FormulaC19H12ClF3
Molecular Weight332.75 g/mol
Exact Mass332.06
IUPAC Name1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene
SMILESCc1cc(-c2ccc(-c3ccccc3F)c(F)c2F)ccc1Cl
InChIInChI=1S/C19H12ClF3/c1-11-10-12(6-9-16(11)20)13-7-8-15(19(23)18(13)22)14-4-2-3-5-17(14)21/h2-10H,1H3
InChIKeyDAUKMOSUMAARRF-UHFFFAOYSA-N
XLogP6.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.75
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3-chloro-4-methylphenyl)-2,3-difluorobenzene
CID 134625893
2-(4-chloro-3-methylphenyl)-6-fluorobenzoic acid
CID 53226778
1,2-difluoro-3-(4-fluoro-3-methylphenyl)benzene
CID 134627237
2-chloro-5-(2-fluorophenyl)phenol
CID 46314345
4-(4-chloro-3-methylphenyl)-2-fluorophenol
CID 53219486
1-fluoro-2-[2-(4-methylphenyl)phenyl]benzene
CID 139250939
1-chloro-2-methyl-4-[2-(trifluoromethoxy)phenyl]benzene
CID 134627988
1-chloro-2-fluoro-3-[3-fluoro-4-(4-methylphenyl)phenyl]benzene
CID 58058665
4-(2-chlorophenyl)-2-methylphenol
CID 53218875
2-(2-fluoro-3-methylphenyl)naphthalene
CID 167454716
4-[4-(2-fluorophenyl)-2-methylphenyl]benzonitrile
CID 118264823
3-(4-chloro-3-fluorophenyl)-2-methylpyridine
CID 90167635

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene?
The IUPAC name of 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene (CID 54264737) is 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene.
What is the SMILES notation for 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene?
The canonical SMILES for 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene is Cc1cc(-c2ccc(-c3ccccc3F)c(F)c2F)ccc1Cl.
What is the InChIKey of 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene?
The InChIKey is DAUKMOSUMAARRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF3/c1-11-10-12(6-9-16(11)20)13-7-8-15(19(23)18(13)22)14-4-2-3-5-17(14)21/h2-10H,1H3.
What are the key properties of 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene?
1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene has a molecular weight of 332.75 g/mol, XLogP of 6.40, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-3-methylphenyl)-2,3-difluoro-4-(2-fluorophenyl)benzene is sourced from PubChem (CID 54264737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).