Octadecanoic acid, 12-amino-, methyl ester
TL;DR: Octadecanoic acid, 12-amino-, methyl ester (CAS 30616-18-3) is a chemical compound with molecular formula C19H39NO2 and molecular weight 313.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 12-aminooctadecanoate
Also Known As: Methyl 12-aminooctadecanoate, methyl 12-aminostearate, 12-Aminooctadecanoicacidmethylester, Methyl 12-aminooctadecanoate #, 12-Aminooctadecanoic acid methyl ester
| Molecular Formula | C19H39NO2 |
|---|---|
| Molecular Weight | 313.30 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 313.29807 |
| Heavy Atoms | 22 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 30616-18-3 |
|---|---|
| SMILES | CCCCCCC(CCCCCCCCCCC(=O)OC)N |
| InChIKey | JDXBXORQIMKXEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octadecanoic acid, 12-amino-, methyl ester (CAS 30616-18-3), with molecular formula C19H39NO2 and molecular weight 313.30 g/mol. IUPAC: methyl 12-aminooctadecanoate.
Chemical Property Profile of Octadecanoic acid, 12-amino-, methyl ester
Property Insights of Octadecanoic acid, 12-amino-, methyl ester
The XLogP value of 6.4 indicates that Octadecanoic acid, 12-amino-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Octadecanoic acid, 12-amino-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecanoic acid, 12-amino-, methyl ester has 1 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 Octadecanoic acid, 12-amino-, methyl ester?
The CAS number of Octadecanoic acid, 12-amino-, methyl ester is 30616-18-3.
What is the molecular formula of Octadecanoic acid, 12-amino-, methyl ester?
The molecular formula of Octadecanoic acid, 12-amino-, methyl ester is C19H39NO2.
What is the molecular weight of Octadecanoic acid, 12-amino-, methyl ester?
The molecular weight of Octadecanoic acid, 12-amino-, methyl ester is 313.30 g/mol.
Where can I buy Octadecanoic acid, 12-amino-, methyl ester?
You can request a quote for Octadecanoic acid, 12-amino-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecanoic acid, 12-amino-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 12-amino-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.