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9-Oxabicyclo[3.3.1]nonane-2,6-diol structure
Fine Chemical

9-Oxabicyclo[3.3.1]nonane-2,6-diol

TL;DR: 9-Oxabicyclo[3.3.1]nonane-2,6-diol (CAS 15458-61-4) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

9-oxabicyclo[3.3.1]nonane-2,6-diol

Also Known As: 9-Oxabicyclo[3.3.1]nonane-2,6-diol, 9-Oxabicyclo(3.3.1)nonane-2,6-diol, 2,6-Dihydroxy-9-oxabicyclo[3.3.1]nonane, exo,exo-2,6-Dihydroxy-9-oxabicyclo<3.3.1>nonan, endo,endo-2,6-Dihydroxy-9-oxabicyclo<3.3.1>nonan

CAS Number
15458-61-4
Molecular Formula
C8H14O3
Molecular Weight
158.0943 g/mol
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Technical Specifications

Molecular FormulaC8H14O3
Molecular Weight158.0943 g/mol
XLogP0.0
Topological Polar Surface Area (TPSA)49.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass158.0943 Da
Heavy Atoms11
Complexity132.0
SMILESC1CC2C(CCC(C1O)O2)O
InChIKeySIZKKURETCQUKI-UHFFFAOYSA-N

Chemical Property Profile of 9-Oxabicyclo[3.3.1]nonane-2,6-diol

XLogP
0.0
TPSA (Topological Polar Surface Area)
49.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
11
Complexity
132.0
Exact Mass
158.0943
Monoisotopic Mass
158.0943
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 9-Oxabicyclo[3.3.1]nonane-2,6-diol

The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Oxabicyclo[3.3.1]nonane-2,6-diol. With a topological polar surface area (TPSA) of 49.7 Ų, 9-Oxabicyclo[3.3.1]nonane-2,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Oxabicyclo[3.3.1]nonane-2,6-diol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 9-Oxabicyclo[3.3.1]nonane-2,6-diol?

The CAS number of 9-Oxabicyclo[3.3.1]nonane-2,6-diol is 15458-61-4.

What is the molecular formula of 9-Oxabicyclo[3.3.1]nonane-2,6-diol?

The molecular formula of 9-Oxabicyclo[3.3.1]nonane-2,6-diol is C8H14O3.

What is the molecular weight of 9-Oxabicyclo[3.3.1]nonane-2,6-diol?

The molecular weight of 9-Oxabicyclo[3.3.1]nonane-2,6-diol is 158.0943 g/mol.

Where can I buy 9-Oxabicyclo[3.3.1]nonane-2,6-diol?

You can request a quote for 9-Oxabicyclo[3.3.1]nonane-2,6-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 9-Oxabicyclo[3.3.1]nonane-2,6-diol?

Yes, CoreyChem provides custom synthesis services for 9-Oxabicyclo[3.3.1]nonane-2,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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