Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester
TL;DR: Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester (CAS 137711-45-6) is a chemical compound with molecular formula C8H8N2O4 and molecular weight 196.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-hydroxy-3-nitrobenzenecarboximidate
Also Known As: methyl m-nitrobenzhydroximate, methyl N-hydroxy-3-nitrobenzenecarboximidate, Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester, methyl N-hydroxy-3-nitrobenzenecarboximidoate, Methyl N-hydroxy-3-nitrobenzene-1-carboximidate
Technical Specifications
| Molecular Formula | C8H8N2O4 |
| Molecular Weight | 196.0484 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 87.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.0484 Da |
| Heavy Atoms | 14 |
| Complexity | 236.0 |
| SMILES | COC(=NO)C1=CC(=CC=C1)[N+](=O)[O-] |
| InChIKey | XFAUFGPUALGSHY-UHFFFAOYSA-N |
Chemical Property Profile of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester
Property Insights of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester. Following Lipinski's Rule of Five, Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester?
The CAS number of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester is 137711-45-6.
What is the molecular formula of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester?
The molecular formula of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester is C8H8N2O4.
What is the molecular weight of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester?
The molecular weight of Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester is 196.0484 g/mol.
Where can I buy Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester?
You can request a quote for Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Benzenecarboximidic acid, N-hydroxy-3-nitro-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.