2-Tridecanone
TL;DR: 2-Tridecanone (CAS 593-08-8) is a chemical compound with molecular formula C13H26O and molecular weight 198.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecan-2-one
Also Known As: 2-TRIDECANONE, Tridecan-2-one, Methyl undecyl ketone, Mathyl undecyl kepoje, 2-Tridecankje
| Molecular Formula | C13H26O |
|---|---|
| Molecular Weight | 198.20 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 198.19836 |
| Heavy Atoms | 14 |
| Complexity | 129.0 |
| Melting Point | 30.1 °C |
| Boiling Point | 262.8 °C at 760 mmHg |
| Density | 0.8217 at 30.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Flash Point | 107.2 °C |
| Vapor Pressure | 1 mmHg at 86.8 °C ; 20 mmHg at 147.8 °C |
| Refractive Index | 1.432-1.438 |
Chemical Identifiers
| CAS Number | 593-08-8 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)C |
| InChIKey | CYIFVRUOHKNECG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Tridecanone (CAS 593-08-8), with molecular formula C13H26O and molecular weight 198.20 g/mol. IUPAC: tridecan-2-one.
Chemical Property Profile of 2-Tridecanone
Property Insights of 2-Tridecanone
The XLogP value of 5.2 indicates that 2-Tridecanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Tridecanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tridecanone 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 2-Tridecanone?
The CAS number of 2-Tridecanone is 593-08-8.
What is the molecular formula of 2-Tridecanone?
The molecular formula of 2-Tridecanone is C13H26O.
What is the molecular weight of 2-Tridecanone?
The molecular weight of 2-Tridecanone is 198.20 g/mol.
Where can I buy 2-Tridecanone?
You can request a quote for 2-Tridecanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tridecanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Tridecanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.