1,3-Nonanediol, 1,3-diacetate
TL;DR: 1,3-Nonanediol, 1,3-diacetate (CAS 63270-14-4) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyloxynonyl acetate
Also Known As: Nonane-1,3-diyl diacetate, diacetate, 1,3-Nonanediol, diacetate, 3-acetyloxynonyl acetate, Nonane diacetate
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 63270-14-4 |
|---|---|
| SMILES | CCCCCCC(CCOC(=O)C)OC(=O)C |
| InChIKey | XUVKIVFZTRZJRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Nonanediol, 1,3-diacetate (CAS 63270-14-4), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: 3-acetyloxynonyl acetate.
Chemical Property Profile of 1,3-Nonanediol, 1,3-diacetate
Property Insights of 1,3-Nonanediol, 1,3-diacetate
The XLogP value of 3.3 indicates that 1,3-Nonanediol, 1,3-diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,3-Nonanediol, 1,3-diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Nonanediol, 1,3-diacetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Nonanediol, 1,3-diacetate?
The CAS number of 1,3-Nonanediol, 1,3-diacetate is 63270-14-4.
What is the molecular formula of 1,3-Nonanediol, 1,3-diacetate?
The molecular formula of 1,3-Nonanediol, 1,3-diacetate is C13H24O4.
What is the molecular weight of 1,3-Nonanediol, 1,3-diacetate?
The molecular weight of 1,3-Nonanediol, 1,3-diacetate is 244.17 g/mol.
Where can I buy 1,3-Nonanediol, 1,3-diacetate?
You can request a quote for 1,3-Nonanediol, 1,3-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Nonanediol, 1,3-diacetate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Nonanediol, 1,3-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.