十三烷二酸
TL;DR: 十三烷二酸 (CAS 505-52-2) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十三烷二酸
tridecanedioic acid
Also Known As: TRIDECANEDIOIC ACID, Brassylic acid, 1,11-Undecanedicarboxylic acid, Brassilic acid, Brassylate
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 191.0 |
| Melting Point | 111 °C |
| Solubility | 1.5 mg/mL at 21 °C |
Chemical Identifiers
| CAS Number | 505-52-2 |
|---|---|
| SMILES | C(CCCCCC(=O)O)CCCCCC(=O)O |
| InChIKey | DXNCZXXFRKPEPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
十三烷二酸 (CAS 505-52-2), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: tridecanedioic acid.
Chemical Property Profile of 十三烷二酸
Property Insights of 十三烷二酸
The XLogP value of 3.7 indicates that 十三烷二酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 十三烷二酸. Following Lipinski's Rule of Five, 十三烷二酸 has 2 hydrogen bond donor(s) and 4 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 十三烷二酸?
The CAS number of 十三烷二酸 is 505-52-2.
What is the molecular formula of 十三烷二酸?
The molecular formula of 十三烷二酸 is C13H24O4.
What is the molecular weight of 十三烷二酸?
The molecular weight of 十三烷二酸 is 244.17 g/mol.
Where can I buy 十三烷二酸?
You can request a quote for 十三烷二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十三烷二酸?
Yes, KEHONG BIO provides custom synthesis services for 十三烷二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.