1,3-Dioxepane, 2-pentadecyl-
TL;DR: 1,3-Dioxepane, 2-pentadecyl- (CAS 42046-91-3) is a chemical compound with molecular formula C20H40O2 and molecular weight 312.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pentadecyl-1,3-dioxepane
Also Known As: 2-Pentadecyl-1,3-dioxepane, 1,3-Dioxepane, 2-pentadecyl-, 2-Pentadecyl-1,3-dioxepane #
| Molecular Formula | C20H40O2 |
|---|---|
| Molecular Weight | 312.30 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 312.30283 |
| Heavy Atoms | 22 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 42046-91-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1OCCCCO1 |
| InChIKey | QZZVQKZZBUCTHK-UHFFFAOYSA-N |
Product Overview
1,3-Dioxepane, 2-pentadecyl- (CAS 42046-91-3), with molecular formula C20H40O2 and molecular weight 312.30 g/mol. IUPAC: 2-pentadecyl-1,3-dioxepane.
Chemical Property Profile of 1,3-Dioxepane, 2-pentadecyl-
Property Insights of 1,3-Dioxepane, 2-pentadecyl-
The XLogP value of 8.3 indicates that 1,3-Dioxepane, 2-pentadecyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxepane, 2-pentadecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxepane, 2-pentadecyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dioxepane, 2-pentadecyl-?
The CAS number of 1,3-Dioxepane, 2-pentadecyl- is 42046-91-3.
What is the molecular formula of 1,3-Dioxepane, 2-pentadecyl-?
The molecular formula of 1,3-Dioxepane, 2-pentadecyl- is C20H40O2.
What is the molecular weight of 1,3-Dioxepane, 2-pentadecyl-?
The molecular weight of 1,3-Dioxepane, 2-pentadecyl- is 312.30 g/mol.
Where can I buy 1,3-Dioxepane, 2-pentadecyl-?
You can request a quote for 1,3-Dioxepane, 2-pentadecyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxepane, 2-pentadecyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxepane, 2-pentadecyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.