![methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate structure](/static/products/122/1227154-43-9.webp)
methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate
TL;DR: methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate (CAS 1227154-43-9) is a chemical compound with molecular formula C9H10N2O3 and molecular weight 194.06914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[(E)-N'-hydroxycarbamimidoyl]benzoate
Also Known As: 3-(N-Hydroxycarbamimidoyl)-benzoic acid meth yl ester, Methyl 3-(-N'-hydroxycarbamimidoyl)benzoate, methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate, (E)-Methyl3-(N'-hydroxycarbamimidoyl)benzoate, 3-(N-Hydroxycarbamimidoyl)-benzoic acid methyl ester
Technical Specifications
| Molecular Formula | C9H10N2O3 |
| Molecular Weight | 194.06914 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.06914 Da |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
| SMILES | COC(=O)C1=CC=CC(=C1)/C(=N\O)/N |
| InChIKey | BELBATQPRYKIIA-UHFFFAOYSA-N |
Chemical Property Profile of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate
Property Insights of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate. Following Lipinski's Rule of Five, methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate?
The CAS number of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate is 1227154-43-9.
What is the molecular formula of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate?
The molecular formula of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate is C9H10N2O3.
What is the molecular weight of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate?
The molecular weight of methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate is 194.06914 g/mol.
Where can I buy methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate?
You can request a quote for methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 3-[(E)-amino(hydroxyimino)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.