(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone

C15H13FO — CID 12739979

IUPAC(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(F)cc2C)cc1
InChIInChI=1S/C15H13FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h3-9H,1-2H3
InChIKeyRQSGBILHAYASGU-UHFFFAOYSA-N
MW228.27 g/mol
LogP3.67
Rot. Bonds2

About (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone

(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone (PubChem CID 12739979) has the molecular formula C15H13FO and a molecular weight of 228.27 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone
PubChem CID12739979
Molecular FormulaC15H13FO
Molecular Weight228.27 g/mol
Exact Mass228.10
IUPAC Name(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(F)cc2C)cc1
InChIInChI=1S/C15H13FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h3-9H,1-2H3
InChIKeyRQSGBILHAYASGU-UHFFFAOYSA-N
XLogP3.67
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[4-fluoro-2-(sulfanylmethyl)phenyl]-(4-methylphenyl)methanone
CID 18779874
(2-amino-5-fluorophenyl)-(4-methylphenyl)methanone
CID 13408102
(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methanone
CID 81273528
2,3-dihydro-1H-inden-5-yl-(4-fluoro-2-methylphenyl)methanone
CID 113399939
1-(4-fluoro-2-methylphenyl)ethanone
CID 3494772
(4-fluorophenyl)-[2-(hydroxymethyl)-4-methylphenyl]methanone
CID 20687997
(2-methylphenyl)-(4-methylphenyl)methanone
CID 6613295
(2,3-dimethylphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 79020544
(2,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanone
CID 43337889
(4-chloro-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 55181742
(4-fluoro-2-methylphenyl)-(1-propylpyrazol-4-yl)methanone
CID 81274285
(4-tert-butylphenyl)-(2,4-dimethylphenyl)methanone
CID 43337773

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone?
The IUPAC name of (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone (CID 12739979) is (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone.
What is the SMILES notation for (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone?
The canonical SMILES for (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone is Cc1ccc(C(=O)c2ccc(F)cc2C)cc1.
What is the InChIKey of (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone?
The InChIKey is RQSGBILHAYASGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h3-9H,1-2H3.
What are the key properties of (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone?
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone has a molecular weight of 228.27 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone is sourced from PubChem (CID 12739979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).