3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one

C160H206Cl6F7NO25 — CID 160713367

IUPAC3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one
SMILESCC(C)C(=O)C(C)(C)C.CC(C)C(=O)C(C)C(C)C(=O)O.CC(C)C(=O)C1CC1.CC(C)C(=O)CC(=O)O.CC(C)C(=O)CC(CC(=O)O)C1CCCCC1.CC(C)C(=O)c1cc(Cl)c(Cl)cc1C(=O)O.CC(C)C(=O)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)c1ccc(Cl)cc1Cl.CC(C)C(=O)c1ccc(F)cc1C(F)(F)F.CC(C)C(=O)c1ccccc1-c1ccccc1.CC(C)C(=O)c1ccccc1C(N)=O.COc1ccccc1C(=O)C(C)C.Cc1ccc(C(=O)C(C)C)c(C(F)(F)F)c1.Cc1ccc(C(=O)C(C)C)c(C)c1.Cc1cccc(C(=O)C(C)C)c1C
InChIInChI=1S/C16H16O.C14H24O3.C12H13F3O.2C12H16O.C11H10Cl2O3.C11H10F4O.C11H13NO2.C11H14O2.2C10H10Cl2O.C9H16O3.C8H16O.C7H12O.C6H10O3/c1-12(2)16(17)15-11-7-6-10-14(15)13-8-4-3-5-9-13;1-10(2)13(15)8-12(9-14(16)17)11-6-4-3-5-7-11;1-7(2)11(16)9-5-4-8(3)6-10(9)12(13,14)15;1-8(2)12(13)11-6-5-9(3)7-10(11)4;1-8(2)12(13)11-7-5-6-9(3)10(11)4;1-5(2)10(14)6-3-8(12)9(13)4-7(6)11(15)16;1-6(2)10(16)8-4-3-7(12)5-9(8)11(13,14)15;1-7(2)10(13)8-5-3-4-6-9(8)11(12)14;1-8(2)11(12)9-6-4-5-7-10(9)13-3;1-6(2)10(13)8-4-3-7(11)5-9(8)12;1-6(2)10(13)7-3-4-8(11)9(12)5-7;1-5(2)8(10)6(3)7(4)9(11)12;1-6(2)7(9)8(3,4)5;1-5(2)7(8)6-3-4-6;1-4(2)5(7)3-6(8)9/h3-12H,1-2H3;10-12H,3-9H2,1-2H3,(H,16,17);4-7H,1-3H3;2*5-8H,1-4H3;3-5H,1-2H3,(H,15,16);3-6H,1-2H3;3-7H,1-2H3,(H2,12,14);4-8H,1-3H3;2*3-6H,1-2H3;5-7H,1-4H3,(H,11,12);6H,1-5H3;5-6H,3-4H2,1-2H3;4H,3H2,1-2H3,(H,8,9)
InChIKeyRSDODWAVXWVVEJ-UHFFFAOYSA-N
MW2889.09 g/mol
LogP42.77
Rot. Bonds40

About 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one

3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one (PubChem CID 160713367) has the molecular formula C160H206Cl6F7NO25 and a molecular weight of 2889.09 g/mol. Its IUPAC name is 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one.

Molecular Properties

Compound Name3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one
PubChem CID160713367
Molecular FormulaC160H206Cl6F7NO25
Molecular Weight2889.09 g/mol
Exact Mass2884.29
IUPAC Name3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one
SMILESCC(C)C(=O)C(C)(C)C.CC(C)C(=O)C(C)C(C)C(=O)O.CC(C)C(=O)C1CC1.CC(C)C(=O)CC(=O)O.CC(C)C(=O)CC(CC(=O)O)C1CCCCC1.CC(C)C(=O)c1cc(Cl)c(Cl)cc1C(=O)O.CC(C)C(=O)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)c1ccc(Cl)cc1Cl.CC(C)C(=O)c1ccc(F)cc1C(F)(F)F.CC(C)C(=O)c1ccccc1-c1ccccc1.CC(C)C(=O)c1ccccc1C(N)=O.COc1ccccc1C(=O)C(C)C.Cc1ccc(C(=O)C(C)C)c(C(F)(F)F)c1.Cc1ccc(C(=O)C(C)C)c(C)c1.Cc1cccc(C(=O)C(C)C)c1C
InChIInChI=1S/C16H16O.C14H24O3.C12H13F3O.2C12H16O.C11H10Cl2O3.C11H10F4O.C11H13NO2.C11H14O2.2C10H10Cl2O.C9H16O3.C8H16O.C7H12O.C6H10O3/c1-12(2)16(17)15-11-7-6-10-14(15)13-8-4-3-5-9-13;1-10(2)13(15)8-12(9-14(16)17)11-6-4-3-5-7-11;1-7(2)11(16)9-5-4-8(3)6-10(9)12(13,14)15;1-8(2)12(13)11-6-5-9(3)7-10(11)4;1-8(2)12(13)11-7-5-6-9(3)10(11)4;1-5(2)10(14)6-3-8(12)9(13)4-7(6)11(15)16;1-6(2)10(16)8-4-3-7(12)5-9(8)11(13,14)15;1-7(2)10(13)8-5-3-4-6-9(8)11(12)14;1-8(2)11(12)9-6-4-5-7-10(9)13-3;1-6(2)10(13)8-4-3-7(11)5-9(8)12;1-6(2)10(13)7-3-4-8(11)9(12)5-7;1-5(2)8(10)6(3)7(4)9(11)12;1-6(2)7(9)8(3,4)5;1-5(2)7(8)6-3-4-6;1-4(2)5(7)3-6(8)9/h3-12H,1-2H3;10-12H,3-9H2,1-2H3,(H,16,17);4-7H,1-3H3;2*5-8H,1-4H3;3-5H,1-2H3,(H,15,16);3-6H,1-2H3;3-7H,1-2H3,(H2,12,14);4-8H,1-3H3;2*3-6H,1-2H3;5-7H,1-4H3,(H,11,12);6H,1-5H3;5-6H,3-4H2,1-2H3;4H,3H2,1-2H3,(H,8,9)
InChIKeyRSDODWAVXWVVEJ-UHFFFAOYSA-N
XLogP42.77
TPSA457.57 Ų
H-Bond Donors5
H-Bond Acceptors21
Rotatable Bonds40
Heavy Atoms199
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002889.09
LogP ≤ 542.77
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one?
The IUPAC name of 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one (CID 160713367) is 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one.
What is the SMILES notation for 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one?
The canonical SMILES for 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one is CC(C)C(=O)C(C)(C)C.CC(C)C(=O)C(C)C(C)C(=O)O.CC(C)C(=O)C1CC1.CC(C)C(=O)CC(=O)O.CC(C)C(=O)CC(CC(=O)O)C1CCCCC1.CC(C)C(=O)c1cc(Cl)c(Cl)cc1C(=O)O.CC(C)C(=O)c1ccc(Cl)c(Cl)c1.CC(C)C(=O)c1ccc(Cl)cc1Cl.CC(C)C(=O)c1ccc(F)cc1C(F)(F)F.CC(C)C(=O)c1ccccc1-c1ccccc1.CC(C)C(=O)c1ccccc1C(N)=O.COc1ccccc1C(=O)C(C)C.Cc1ccc(C(=O)C(C)C)c(C(F)(F)F)c1.Cc1ccc(C(=O)C(C)C)c(C)c1.Cc1cccc(C(=O)C(C)C)c1C.
What is the InChIKey of 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one?
The InChIKey is RSDODWAVXWVVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O.C14H24O3.C12H13F3O.2C12H16O.C11H10Cl2O3.C11H10F4O.C11H13NO2.C11H14O2.2C10H10Cl2O.C9H16O3.C8H16O.C7H12O.C6H10O3/c1-12(2)16(17)15-11-7-6-10-14(15)13-8-4-3-5-9-13;1-10(2)13(15)8-12(9-14(16)17)11-6-4-3-5-7-11;1-7(2)11(16)9-5-4-8(3)6-10(9)12(13,14)15;1-8(2)12(13)11-6-5-9(3)7-10(11)4;1-8(2)12(13)11-7-5-6-9(3)10(11)4;1-5(2)10(14)6-3-8(12)9(13)4-7(6)11(15)16;1-6(2)10(16)8-4-3-7(12)5-9(8)11(13,14)15;1-7(2)10(13)8-5-3-4-6-9(8)11(12)14;1-8(2)11(12)9-6-4-5-7-10(9)13-3;1-6(2)10(13)8-4-3-7(11)5-9(8)12;1-6(2)10(13)7-3-4-8(11)9(12)5-7;1-5(2)8(10)6(3)7(4)9(11)12;1-6(2)7(9)8(3,4)5;1-5(2)7(8)6-3-4-6;1-4(2)5(7)3-6(8)9/h3-12H,1-2H3;10-12H,3-9H2,1-2H3,(H,16,17);4-7H,1-3H3;2*5-8H,1-4H3;3-5H,1-2H3,(H,15,16);3-6H,1-2H3;3-7H,1-2H3,(H2,12,14);4-8H,1-3H3;2*3-6H,1-2H3;5-7H,1-4H3,(H,11,12);6H,1-5H3;5-6H,3-4H2,1-2H3;4H,3H2,1-2H3,(H,8,9).
What are the key properties of 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one?
3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one has a molecular weight of 2889.09 g/mol, XLogP of 42.77, 40 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-6-methyl-5-oxoheptanoic acid;1-cyclopropyl-2-methylpropan-1-one;4,5-dichloro-2-(2-methylpropanoyl)benzoic acid;1-(2,4-dichlorophenyl)-2-methylpropan-1-one;1-(3,4-dichlorophenyl)-2-methylpropan-1-one;1-(2,3-dimethylphenyl)-2-methylpropan-1-one;1-(2,4-dimethylphenyl)-2-methylpropan-1-one;1-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpropan-1-one;1-(2-methoxyphenyl)-2-methylpropan-1-one;2-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]propan-1-one;4-methyl-3-oxopentanoic acid;2-methyl-1-(2-phenylphenyl)propan-1-one;2-(2-methylpropanoyl)benzamide;2,3,5-trimethyl-4-oxohexanoic acid;2,2,4-trimethylpentan-3-one is sourced from PubChem (CID 160713367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).