Ethanimidic acid, N-methyl-, methyl ester
TL;DR: Ethanimidic acid, N-methyl-, methyl ester (CAS 52008-67-0) is a chemical compound with molecular formula C4H9NO and molecular weight 87.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-methylethanimidate
Also Known As: methyl N-methylacetimidate, methyl N-methylethanimidate, Ethanimidic acid, N-methyl-, methyl ester, N-Methyl-1-methoxyethane1-imine, Methyl (1E)-N-methylethanimidate
| Molecular Formula | C4H9NO |
|---|---|
| Molecular Weight | 87.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 87.06841 |
| Heavy Atoms | 6 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 52008-67-0 |
|---|---|
| SMILES | CC(=NC)OC |
| InChIKey | ZVSTUQXCWRZVJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanimidic acid, N-methyl-, methyl ester (CAS 52008-67-0), with molecular formula C4H9NO and molecular weight 87.07 g/mol. IUPAC: methyl N-methylethanimidate.
Chemical Property Profile of Ethanimidic acid, N-methyl-, methyl ester
Property Insights of Ethanimidic acid, N-methyl-, methyl ester
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanimidic acid, N-methyl-, methyl ester. With a topological polar surface area (TPSA) of 21.6 Ų, Ethanimidic acid, N-methyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanimidic acid, N-methyl-, methyl ester has 0 hydrogen bond donor(s) and 2 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 Ethanimidic acid, N-methyl-, methyl ester?
The CAS number of Ethanimidic acid, N-methyl-, methyl ester is 52008-67-0.
What is the molecular formula of Ethanimidic acid, N-methyl-, methyl ester?
The molecular formula of Ethanimidic acid, N-methyl-, methyl ester is C4H9NO.
What is the molecular weight of Ethanimidic acid, N-methyl-, methyl ester?
The molecular weight of Ethanimidic acid, N-methyl-, methyl ester is 87.07 g/mol.
Where can I buy Ethanimidic acid, N-methyl-, methyl ester?
You can request a quote for Ethanimidic acid, N-methyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanimidic acid, N-methyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Ethanimidic acid, N-methyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.