3-(Dimethylamino)propyl acetate
TL;DR: 3-(Dimethylamino)propyl acetate (CAS 4339-94-0) is a chemical compound with molecular formula C7H15NO2 and molecular weight 145.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl acetate
Also Known As: 3-(Dimethylamino)propyl acetate, (CH3)2N(CH2)3OCOCH3, propane, 1-acetoxy-3-dimethylamino-, 1-Propanol, 3-(dimethylamino)-, acetate, Acetic acid 3-(dimethylamino)propyl ester
| Molecular Formula | C7H15NO2 |
|---|---|
| Molecular Weight | 145.11 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 145.11028 |
| Heavy Atoms | 10 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 4339-94-0 |
|---|---|
| SMILES | CC(=O)OCCCN(C)C |
| InChIKey | QIOHHDBZBVJGCT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Dimethylamino)propyl acetate (CAS 4339-94-0), with molecular formula C7H15NO2 and molecular weight 145.11 g/mol. IUPAC: 3-(dimethylamino)propyl acetate.
Chemical Property Profile of 3-(Dimethylamino)propyl acetate
Property Insights of 3-(Dimethylamino)propyl acetate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Dimethylamino)propyl acetate. With a topological polar surface area (TPSA) of 29.5 Ų, 3-(Dimethylamino)propyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)propyl acetate has 0 hydrogen bond donor(s) and 3 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 3-(Dimethylamino)propyl acetate?
The CAS number of 3-(Dimethylamino)propyl acetate is 4339-94-0.
What is the molecular formula of 3-(Dimethylamino)propyl acetate?
The molecular formula of 3-(Dimethylamino)propyl acetate is C7H15NO2.
What is the molecular weight of 3-(Dimethylamino)propyl acetate?
The molecular weight of 3-(Dimethylamino)propyl acetate is 145.11 g/mol.
Where can I buy 3-(Dimethylamino)propyl acetate?
You can request a quote for 3-(Dimethylamino)propyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)propyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)propyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.