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2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione structure
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2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione

TL;DR: 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione (CAS 314766-20-6) is a chemical compound with molecular formula C19H28O6 and molecular weight 352.1886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)propyl]-5,5-dimethylcyclohexane-1,3-dione

Also Known As: 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione, AN-329/07014061, 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)propyl]-5,5-dimethylcyclohexane-1,3-dione, 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propyl]-5,5-dimethylcyclohexane-1,3-dione, 2-[2,3-dihydroxy-1-(6-hydroxy-4,4-dimethyl-2-oxocyclohex-1(6)-enyl)propyl]-5,5 -dimethylcyclohexane-1,3-dione

CAS Number
314766-20-6
Molecular Formula
C19H28O6
Molecular Weight
352.1886 g/mol
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Technical Specifications

Molecular FormulaC19H28O6
Molecular Weight352.1886 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)112.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass352.1886 Da
Heavy Atoms25
Complexity608.0
SMILESCC1(CC(=O)C(C(=O)C1)C(C2=C(CC(CC2=O)(C)C)O)C(CO)O)C
InChIKeyFWHOAFPFQCIKGL-UHFFFAOYSA-N

Chemical Property Profile of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione

XLogP
0.5
TPSA (Topological Polar Surface Area)
112.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
25
Complexity
608.0
Exact Mass
352.1886
Monoisotopic Mass
352.1886
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione. Following Lipinski's Rule of Five, 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione?

The CAS number of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione is 314766-20-6.

What is the molecular formula of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione?

The molecular formula of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione is C19H28O6.

What is the molecular weight of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione?

The molecular weight of 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione is 352.1886 g/mol.

Where can I buy 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione?

You can request a quote for 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione?

Yes, CoreyChem provides custom synthesis services for 2-[2,3-dihydroxy-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)propyl]-5,5-dimethyl-1,3-cyclohexanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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