(2,4-dichlorophenyl)-(3-fluorophenyl)methanone

C13H7Cl2FO — CID 61271846

IUPAC(2,4-dichlorophenyl)-(3-fluorophenyl)methanone
SMILESO=C(c1cccc(F)c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H7Cl2FO/c14-9-4-5-11(12(15)7-9)13(17)8-2-1-3-10(16)6-8/h1-7H
InChIKeyADLJITFIFRVNDP-UHFFFAOYSA-N
MW269.10 g/mol
LogP4.36
Rot. Bonds2

About (2,4-dichlorophenyl)-(3-fluorophenyl)methanone

(2,4-dichlorophenyl)-(3-fluorophenyl)methanone (PubChem CID 61271846) has the molecular formula C13H7Cl2FO and a molecular weight of 269.10 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(3-fluorophenyl)methanone.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(3-fluorophenyl)methanone
PubChem CID61271846
Molecular FormulaC13H7Cl2FO
Molecular Weight269.10 g/mol
Exact Mass267.99
IUPAC Name(2,4-dichlorophenyl)-(3-fluorophenyl)methanone
SMILESO=C(c1cccc(F)c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H7Cl2FO/c14-9-4-5-11(12(15)7-9)13(17)8-2-1-3-10(16)6-8/h1-7H
InChIKeyADLJITFIFRVNDP-UHFFFAOYSA-N
XLogP4.36
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.10
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromo-4-chlorophenyl)-(3-fluorophenyl)methanone
CID 107996213
(2,4-dichlorophenyl)-(3,4-difluorophenyl)methanone
CID 43338229
(2,4-dichlorophenyl)-(3-methylsulfanylphenyl)methanone
CID 146007568
(2,5-difluorophenyl)-(3-fluorophenyl)methanone
CID 43159843
(2,4-dichlorophenyl)-(3,4,5-trifluorophenyl)methanone
CID 63187591
(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone
CID 43159987
(5-chloro-2-fluorophenyl)-(3-chlorophenyl)methanone
CID 112694065
(3-chloro-2-fluorophenyl)-(2,4-dichlorophenyl)methanone
CID 81265376
(2,4-dichlorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanone
CID 107291213
(2,4-dichlorophenyl)-(3-propylphenyl)methanone
CID 115812034
(2,4-dichlorophenyl)-(4-fluoro-3,5-dimethylphenyl)methanone
CID 65299220
2,4-dichloro-N-[(3-fluorophenyl)methyl]benzamide
CID 127502749

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(3-fluorophenyl)methanone?
The IUPAC name of (2,4-dichlorophenyl)-(3-fluorophenyl)methanone (CID 61271846) is (2,4-dichlorophenyl)-(3-fluorophenyl)methanone.
What is the SMILES notation for (2,4-dichlorophenyl)-(3-fluorophenyl)methanone?
The canonical SMILES for (2,4-dichlorophenyl)-(3-fluorophenyl)methanone is O=C(c1cccc(F)c1)c1ccc(Cl)cc1Cl.
What is the InChIKey of (2,4-dichlorophenyl)-(3-fluorophenyl)methanone?
The InChIKey is ADLJITFIFRVNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl2FO/c14-9-4-5-11(12(15)7-9)13(17)8-2-1-3-10(16)6-8/h1-7H.
What are the key properties of (2,4-dichlorophenyl)-(3-fluorophenyl)methanone?
(2,4-dichlorophenyl)-(3-fluorophenyl)methanone has a molecular weight of 269.10 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(3-fluorophenyl)methanone is sourced from PubChem (CID 61271846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).