乙酸;十八碳-9-烯-1-胺
TL;DR: 乙酸;十八碳-9-烯-1-胺 (CAS 3811-68-5) is a chemical compound with molecular formula C20H41NO2 and molecular weight 327.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酸;十八碳-9-烯-1-胺
acetic acid;octadec-9-en-1-amine
Also Known As: Octadec-9-enylammonium acetate, acetic acid; (E)-octadec-9-en-1-amine
| Molecular Formula | C20H41NO2 |
|---|---|
| Molecular Weight | 327.31 g/mol |
| LogP | 6.07 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 327.31372 |
| Heavy Atoms | 23 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 3811-68-5 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCN.CC(=O)O |
| InChIKey | NLGOTHQMVKZTBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙酸;十八碳-9-烯-1-胺 (CAS 3811-68-5), with molecular formula C20H41NO2 and molecular weight 327.31 g/mol. IUPAC: acetic acid;octadec-9-en-1-amine.
Chemical Property Profile of 乙酸;十八碳-9-烯-1-胺
Property Insights of 乙酸;十八碳-9-烯-1-胺
The XLogP value of 6.07 indicates that 乙酸;十八碳-9-烯-1-胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 乙酸;十八碳-9-烯-1-胺. Following Lipinski's Rule of Five, 乙酸;十八碳-9-烯-1-胺 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 乙酸;十八碳-9-烯-1-胺?
The CAS number of 乙酸;十八碳-9-烯-1-胺 is 3811-68-5.
What is the molecular formula of 乙酸;十八碳-9-烯-1-胺?
The molecular formula of 乙酸;十八碳-9-烯-1-胺 is C20H41NO2.
What is the molecular weight of 乙酸;十八碳-9-烯-1-胺?
The molecular weight of 乙酸;十八碳-9-烯-1-胺 is 327.31 g/mol.
Where can I buy 乙酸;十八碳-9-烯-1-胺?
You can request a quote for 乙酸;十八碳-9-烯-1-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酸;十八碳-9-烯-1-胺?
Yes, KEHONG BIO provides custom synthesis services for 乙酸;十八碳-9-烯-1-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.