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4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid structure
Fine Chemical

4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid

TL;DR: 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid (CAS 146728-81-6) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.05283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-oxo-3,10-dioxatricyclo[5.2.1.01,5]decane-6-carboxylic acid

Also Known As: 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid, 1-Oxohexahydro-3h-3a,6-epoxyisobenzofuran-7-carboxylic acid, 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylicacid, 4-oxo-3,10-dioxatricyclo[5.2.1.0~1,5~]decane-6-carboxylic acid, rac-(1R,5S,6R,7S)-4-oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid

CAS Number
146728-81-6
Molecular Formula
C9H10O5
Molecular Weight
198.05283 g/mol
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Technical Specifications

Molecular FormulaC9H10O5
Molecular Weight198.05283 g/mol
XLogP-0.5
Topological Polar Surface Area (TPSA)72.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass198.05283 Da
Heavy Atoms14
Complexity325.0
SMILESC1CC23COC(=O)C2C(C1O3)C(=O)O
InChIKeyZTNJBIVXMUDZMQ-UHFFFAOYSA-N

Chemical Property Profile of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid

XLogP
-0.5
TPSA (Topological Polar Surface Area)
72.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
14
Complexity
325.0
Exact Mass
198.05283
Monoisotopic Mass
198.05283
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 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid

The XLogP value of -0.5 indicates that 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid. Following Lipinski's Rule of Five, 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid?

The CAS number of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid is 146728-81-6.

What is the molecular formula of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid?

The molecular formula of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid is C9H10O5.

What is the molecular weight of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid?

The molecular weight of 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid is 198.05283 g/mol.

Where can I buy 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid?

You can request a quote for 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid?

Yes, CoreyChem provides custom synthesis services for 4-Oxo-3,10-dioxatricyclo[5.2.1.0,1,5]decane-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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