4-Heptadecanone
TL;DR: 4-Heptadecanone (CAS 53685-77-1) is a chemical compound with molecular formula C17H34O and molecular weight 254.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptadecan-4-one
Also Known As: 4-Heptadecanone, Heptadecan-4-one, n-Propyl n-tridecyl ketone, I14-57569
| Molecular Formula | C17H34O |
|---|---|
| Molecular Weight | 254.26 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 254.26097 |
| Heavy Atoms | 18 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 53685-77-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=O)CCC |
| InChIKey | UIDOOQRSFZDBLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Heptadecanone (CAS 53685-77-1), with molecular formula C17H34O and molecular weight 254.26 g/mol. IUPAC: heptadecan-4-one.
Chemical Property Profile of 4-Heptadecanone
Property Insights of 4-Heptadecanone
The XLogP value of 7.1 indicates that 4-Heptadecanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Heptadecanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Heptadecanone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Heptadecanone?
The CAS number of 4-Heptadecanone is 53685-77-1.
What is the molecular formula of 4-Heptadecanone?
The molecular formula of 4-Heptadecanone is C17H34O.
What is the molecular weight of 4-Heptadecanone?
The molecular weight of 4-Heptadecanone is 254.26 g/mol.
Where can I buy 4-Heptadecanone?
You can request a quote for 4-Heptadecanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Heptadecanone?
Yes, KEHONG BIO provides custom synthesis services for 4-Heptadecanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.