2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone

C15H11Cl2FO — CID 65317110

IUPAC2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)Cc2cc(Cl)ccc2Cl)cc1F
InChIInChI=1S/C15H11Cl2FO/c1-9-2-3-10(7-14(9)18)15(19)8-11-6-12(16)4-5-13(11)17/h2-7H,8H2,1H3
InChIKeyPNSPQXOFCBCFHL-UHFFFAOYSA-N
MW297.16 g/mol
LogP4.87
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone

2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone (PubChem CID 65317110) has the molecular formula C15H11Cl2FO and a molecular weight of 297.16 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
PubChem CID65317110
Molecular FormulaC15H11Cl2FO
Molecular Weight297.16 g/mol
Exact Mass296.02
IUPAC Name2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)Cc2cc(Cl)ccc2Cl)cc1F
InChIInChI=1S/C15H11Cl2FO/c1-9-2-3-10(7-14(9)18)15(19)8-11-6-12(16)4-5-13(11)17/h2-7H,8H2,1H3
InChIKeyPNSPQXOFCBCFHL-UHFFFAOYSA-N
XLogP4.87
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.16
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,5-dichlorophenyl)-1-(4-fluorophenyl)ethanone
CID 65316679
2-(3-chloro-2-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 102857168
1-(5-chloro-2-methylphenyl)-2-(2,5-dichlorophenyl)ethanone
CID 114973852
1-(3-amino-4-methylphenyl)-2-(5-chloro-2-fluorophenyl)ethanone
CID 103052274
2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanone
CID 102617587
2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 62622276
2-(2-bromophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 54919565
(3-chloro-4-fluorophenyl)-(3-fluoro-4-methylphenyl)methanone
CID 113254895
1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373147
2-(3-chloro-2-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethanone
CID 82801937
1-(3-bromo-4-fluorophenyl)-2-(2-chloro-5-fluorophenyl)ethanone
CID 102617798
2-(4-bromophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 60797592

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone (CID 65317110) is 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone is Cc1ccc(C(=O)Cc2cc(Cl)ccc2Cl)cc1F.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The InChIKey is PNSPQXOFCBCFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2FO/c1-9-2-3-10(7-14(9)18)15(19)8-11-6-12(16)4-5-13(11)17/h2-7H,8H2,1H3.
What are the key properties of 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone has a molecular weight of 297.16 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone is sourced from PubChem (CID 65317110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).