TL;DR: Methyl acetimidate (CAS 14777-29-8) is a chemical compound with molecular formula C3H7NO and molecular weight 73.052765 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl ethanimidate
Also Known As: Methyl acetimidate, methyl ethanimidate, Ethanimidic acid, methyl ester, 1-Methoxyethanimine, Methyl ethanecarboximidate
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C3H7NO |
| Molecular Weight | 73.052765 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 73.052765 Da |
| Heavy Atoms | 5 |
| Complexity | 42.0 |
| SMILES | CC(=N)OC |
| InChIKey | SJFKGZZCMREBQH-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl acetimidate. With a topological polar surface area (TPSA) of 33.1 Ų, Methyl acetimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl acetimidate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methyl acetimidate is 14777-29-8.
The molecular formula of Methyl acetimidate is C3H7NO.
The molecular weight of Methyl acetimidate is 73.052765 g/mol.
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