Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester
TL;DR: Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester (CAS 79403-22-8) is a chemical compound with molecular formula C17H35NO2 and molecular weight 285.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)propan-2-yl dodecanoate
Also Known As: 1-(dimethylamino)propan-2-yl dodecanoate, Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester, 1-dimethylaminopropan-2-yl dodecanoate, (N,N-dimethylamino)-2-propanol dodecanoate, (E,E)-Tributyl(hexa-2,4-dienoyloxy)stannane
| Molecular Formula | C17H35NO2 |
|---|---|
| Molecular Weight | 285.27 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 285.26678 |
| Heavy Atoms | 20 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 79403-22-8 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OC(C)CN(C)C |
| InChIKey | KTPHASGENPMMQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester (CAS 79403-22-8), with molecular formula C17H35NO2 and molecular weight 285.27 g/mol. IUPAC: 1-(dimethylamino)propan-2-yl dodecanoate.
Chemical Property Profile of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester
Property Insights of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester
The XLogP value of 5.7 indicates that Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester has 0 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 Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester?
The CAS number of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester is 79403-22-8.
What is the molecular formula of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester?
The molecular formula of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester is C17H35NO2.
What is the molecular weight of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester?
The molecular weight of Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester is 285.27 g/mol.
Where can I buy Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester?
You can request a quote for Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Dodecanoic acid, 2-(dimethylamino)-1-methylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.