(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone

C15H12Cl2O — CID 2758091

IUPAC(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone
SMILESCc1cc(C)cc(C(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H12Cl2O/c1-9-5-10(2)7-12(6-9)15(18)11-3-4-13(16)14(17)8-11/h3-8H,1-2H3
InChIKeyRDVPVZVOVOIJLF-UHFFFAOYSA-N
MW279.17 g/mol
LogP4.84
Rot. Bonds2

About (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone

(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone (PubChem CID 2758091) has the molecular formula C15H12Cl2O and a molecular weight of 279.17 g/mol. Its IUPAC name is (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone.

Molecular Properties

Compound Name(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone
PubChem CID2758091
Molecular FormulaC15H12Cl2O
Molecular Weight279.17 g/mol
Exact Mass278.03
IUPAC Name(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone
SMILESCc1cc(C)cc(C(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H12Cl2O/c1-9-5-10(2)7-12(6-9)15(18)11-3-4-13(16)14(17)8-11/h3-8H,1-2H3
InChIKeyRDVPVZVOVOIJLF-UHFFFAOYSA-N
XLogP4.84
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.17
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chloro-4-fluorophenyl)-(3,5-dimethylphenyl)methanone
CID 55186407
(4-amino-3,5-dichlorophenyl)-(3,5-dimethylphenyl)methanone
CID 116609737
(3,4-dichlorophenyl)-(3,5-difluorophenyl)methanone
CID 2758085
(2,5-dichlorophenyl)-(3,5-dimethylphenyl)methanone
CID 43344611
(3-chloro-4-iodophenyl)-(3-fluoro-5-methylphenyl)methanone
CID 103214281
methyl 4-[4-(3,4-dichlorobenzoyl)benzoyl]benzoate
CID 10409472
(3,4-dichlorophenyl)-(4-methoxyphenyl)methanone
CID 2758123
[4-(4-chloro-3-methylbenzoyl)phenyl]-(4-chloro-3-methylphenyl)methanone
CID 5143805
[4-(3,4-dichlorobenzoyl)phenyl] acetate
CID 24723041
(4-chloro-3-methylphenyl)-(3-methylphenyl)methanone
CID 112694024
(3,5-dimethylphenyl)-(4-fluorophenyl)methanone
CID 43159976
(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone
CID 12639783

Frequently Asked Questions

What is the IUPAC name of (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone?
The IUPAC name of (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone (CID 2758091) is (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone.
What is the SMILES notation for (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone?
The canonical SMILES for (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone is Cc1cc(C)cc(C(=O)c2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone?
The InChIKey is RDVPVZVOVOIJLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2O/c1-9-5-10(2)7-12(6-9)15(18)11-3-4-13(16)14(17)8-11/h3-8H,1-2H3.
What are the key properties of (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone?
(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone has a molecular weight of 279.17 g/mol, XLogP of 4.84, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone is sourced from PubChem (CID 2758091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).