Pentadecan-6-one
TL;DR: Pentadecan-6-one (CAS 1001-45-2) is a chemical compound with molecular formula C15H30O and molecular weight 226.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentadecan-6-one
Also Known As: 6-Pentadecanone, Pentadecan-6-one, Nonylpentyl ketone, 213-681-6, EINECS 213-681-6
| Molecular Formula | C15H30O |
|---|---|
| Molecular Weight | 226.23 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 226.22966 |
| Heavy Atoms | 16 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 1001-45-2 |
|---|---|
| SMILES | CCCCCCCCCC(=O)CCCCC |
| InChIKey | YSHXMTRDMDYAEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentadecan-6-one (CAS 1001-45-2), with molecular formula C15H30O and molecular weight 226.23 g/mol. IUPAC: pentadecan-6-one.
Chemical Property Profile of Pentadecan-6-one
Property Insights of Pentadecan-6-one
The XLogP value of 6.0 indicates that Pentadecan-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Pentadecan-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentadecan-6-one 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 Pentadecan-6-one?
The CAS number of Pentadecan-6-one is 1001-45-2.
What is the molecular formula of Pentadecan-6-one?
The molecular formula of Pentadecan-6-one is C15H30O.
What is the molecular weight of Pentadecan-6-one?
The molecular weight of Pentadecan-6-one is 226.23 g/mol.
Where can I buy Pentadecan-6-one?
You can request a quote for Pentadecan-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentadecan-6-one?
Yes, KEHONG BIO provides custom synthesis services for Pentadecan-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.