芥酸
TL;DR: 芥酸 (CAS 112-86-7) is a chemical compound with molecular formula C22H42O2 and molecular weight 338.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芥酸
docos-13-enoic acid
Also Known As: ERUCIC ACID, 13-Docosenoic acid, docos-13-enoic acid, Brassidic acid, Erucic acid 98%
| Molecular Formula | C22H42O2 |
|---|---|
| Molecular Weight | 338.32 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 338.31848 |
| Heavy Atoms | 24 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 112-86-7 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCCCCC(=O)O |
| InChIKey | DPUOLQHDNGRHBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
芥酸 (CAS 112-86-7), with molecular formula C22H42O2 and molecular weight 338.32 g/mol. IUPAC: docos-13-enoic acid.
Chemical Property Profile of 芥酸
Property Insights of 芥酸
The XLogP value of 8.7 indicates that 芥酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 芥酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 芥酸 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 芥酸?
The CAS number of 芥酸 is 112-86-7.
What is the molecular formula of 芥酸?
The molecular formula of 芥酸 is C22H42O2.
What is the molecular weight of 芥酸?
The molecular weight of 芥酸 is 338.32 g/mol.
Where can I buy 芥酸?
You can request a quote for 芥酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芥酸?
Yes, KEHONG BIO provides custom synthesis services for 芥酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.