2-(Diethylamino) ethylcrotonate
TL;DR: 2-(Diethylamino) ethylcrotonate (CAS 84115-05-9) is a chemical compound with molecular formula C10H19NO2 and molecular weight 185.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl (E)-but-2-enoate
Also Known As: 2-(diethylamino) ethylcrotonate, 2-(diethylamino)ethyl crotonate, 2-diethylaminoethyl (E)-but-2-enoate, Crotonic acid 2-(diethylamino)ethyl ester, 2-(diethylamino)ethyl (2E)-but-2-enoate
| Molecular Formula | C10H19NO2 |
|---|---|
| Molecular Weight | 185.14 g/mol |
| LogP | 1.4475 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 185.14159 |
| Heavy Atoms | 13 |
| Complexity | 162.30768 |
Chemical Identifiers
| CAS Number | 84115-05-9 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)/C=C/C |
Product Overview
2-(Diethylamino) ethylcrotonate (CAS 84115-05-9), with molecular formula C10H19NO2 and molecular weight 185.14 g/mol. IUPAC: 2-(diethylamino)ethyl (E)-but-2-enoate.
Chemical Property Profile of 2-(Diethylamino) ethylcrotonate
Property Insights of 2-(Diethylamino) ethylcrotonate
The XLogP value of 1.4475 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diethylamino) ethylcrotonate. With a topological polar surface area (TPSA) of 29.54 Ų, 2-(Diethylamino) ethylcrotonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino) ethylcrotonate 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 2-(Diethylamino) ethylcrotonate?
The CAS number of 2-(Diethylamino) ethylcrotonate is 84115-05-9.
What is the molecular formula of 2-(Diethylamino) ethylcrotonate?
The molecular formula of 2-(Diethylamino) ethylcrotonate is C10H19NO2.
What is the molecular weight of 2-(Diethylamino) ethylcrotonate?
The molecular weight of 2-(Diethylamino) ethylcrotonate is 185.14 g/mol.
Where can I buy 2-(Diethylamino) ethylcrotonate?
You can request a quote for 2-(Diethylamino) ethylcrotonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino) ethylcrotonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino) ethylcrotonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.