12-十三碳炔酸
TL;DR: 12-十三碳炔酸 (CAS 14502-46-6) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-十三碳炔酸
tridec-12-ynoic acid
Also Known As: 12-Tridecynoic acid, tridec-12-ynoic acid, null, 6-bromo-2-oxo-2,3,4,8-tetrahydro-1,8-naphthyridine-3-carboxylic acid, (2s)-3-(Hexadecanoyloxy)-2-[(9z)-Octadec-9-Enoyloxy]propyl 2-(Trimethylammonio)ethyl Phosphate
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 3.6052 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 191.20287 |
Chemical Identifiers
| CAS Number | 14502-46-6 |
|---|---|
| SMILES | C#CCCCCCCCCCCC(=O)O |
Product Overview
12-十三碳炔酸 (CAS 14502-46-6), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: tridec-12-ynoic acid.
Chemical Property Profile of 12-十三碳炔酸
Property Insights of 12-十三碳炔酸
The XLogP value of 3.6052 indicates that 12-十三碳炔酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 12-十三碳炔酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-十三碳炔酸 has 1 hydrogen bond donor(s) and 1 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 12-十三碳炔酸?
The CAS number of 12-十三碳炔酸 is 14502-46-6.
What is the molecular formula of 12-十三碳炔酸?
The molecular formula of 12-十三碳炔酸 is C13H22O2.
What is the molecular weight of 12-十三碳炔酸?
The molecular weight of 12-十三碳炔酸 is 210.16 g/mol.
Where can I buy 12-十三碳炔酸?
You can request a quote for 12-十三碳炔酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-十三碳炔酸?
Yes, KEHONG BIO provides custom synthesis services for 12-十三碳炔酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.