Ethyl trans-3-dimethylaminoacrylate
TL;DR: Ethyl trans-3-dimethylaminoacrylate (CAS 98278-07-0) is a chemical compound with molecular formula C7H13NO2 and molecular weight 143.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-(dimethylamino)prop-2-enoate
Also Known As: Ethyl 3-(N,N-dimethylamino)acrylate, Ethyl 3-(Dimethylamino)acrylate, (E)-Ethyl 3-(dimethylamino)acrylate, ethyl3- acrylate, Ethyl trans-3-dimethylaminoacrylate
| Molecular Formula | C7H13NO2 |
|---|---|
| Molecular Weight | 143.09 g/mol |
| LogP | 0.6248 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 143.09464 |
| Heavy Atoms | 10 |
| Complexity | 129.5678 |
Chemical Identifiers
| CAS Number | 98278-07-0 |
|---|---|
| SMILES | CCOC(=O)/C=C/N(C)C |
Product Overview
Ethyl trans-3-dimethylaminoacrylate (CAS 98278-07-0), with molecular formula C7H13NO2 and molecular weight 143.09 g/mol. IUPAC: ethyl (E)-3-(dimethylamino)prop-2-enoate.
Chemical Property Profile of Ethyl trans-3-dimethylaminoacrylate
Property Insights of Ethyl trans-3-dimethylaminoacrylate
The XLogP value of 0.6248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl trans-3-dimethylaminoacrylate. With a topological polar surface area (TPSA) of 29.54 Ų, Ethyl trans-3-dimethylaminoacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl trans-3-dimethylaminoacrylate 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 Ethyl trans-3-dimethylaminoacrylate?
The CAS number of Ethyl trans-3-dimethylaminoacrylate is 98278-07-0.
What is the molecular formula of Ethyl trans-3-dimethylaminoacrylate?
The molecular formula of Ethyl trans-3-dimethylaminoacrylate is C7H13NO2.
What is the molecular weight of Ethyl trans-3-dimethylaminoacrylate?
The molecular weight of Ethyl trans-3-dimethylaminoacrylate is 143.09 g/mol.
Where can I buy Ethyl trans-3-dimethylaminoacrylate?
You can request a quote for Ethyl trans-3-dimethylaminoacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl trans-3-dimethylaminoacrylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl trans-3-dimethylaminoacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.