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2-[(4,4-dimethyl-2,6-dioxocyclohexyl)(3-methylphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

2-[(4,4-dimethyl-2,6-dioxocyclohexyl)(3-methylphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

Formula: C24H30O4

SMILES: CC1=CC=CC(=C1)C(C1C(=O)CC(C)(C)CC1=O)C1C(=O)CC(C)(C)CC1=O

IUPAC: 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)(3-methylphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

InChI: InChI=1S/C24H30O4/c1-14-7-6-8-15(9-14)20(21-16(25)10-23(2,3)11-17(21)26)22-18(27)12-24(4,5)13-19(22)28/h6-9,20-22H,10-13H2,1-5H3

Composition: C (75.36%), H (7.91%), O (16.73%)

Molar Mass: 382.5

Atom Count: 58

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 382.214409446
Formal Charge 0
FSP3 0.58
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey GVNUXRYXLVHYGU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.36
Topological Polar Surface Area 68.28
Polarizability 42.23
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H30O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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