![[3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate structure](/static/products/352/352519-36-9.png)
[3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate
TL;DR: [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate (CAS 352519-36-9) is a chemical compound with molecular formula C14H9N3O7 and molecular weight 331.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate
Also Known As: [3-(hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate, 3-[(hydroxyimino)methyl]phenyl 3,5-bisnitrobenzoate
| Molecular Formula | C14H9N3O7 |
|---|---|
| Molecular Weight | 331.04 g/mol |
| LogP | 2.5303 |
| Topological Polar Surface Area | 145.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.04404 |
| Heavy Atoms | 24 |
| Complexity | 815.7618 |
Chemical Identifiers
| CAS Number | 352519-36-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C=NO |
Product Overview
[3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate (CAS 352519-36-9), with molecular formula C14H9N3O7 and molecular weight 331.04 g/mol. IUPAC: [3-(hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate.
Chemical Property Profile of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate
Property Insights of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate
The XLogP value of 2.5303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate. The TPSA of 145.17 Ų indicates high polarity, suggesting [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate has 1 hydrogen bond donor(s) and 8 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 [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate?
The CAS number of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate is 352519-36-9.
What is the molecular formula of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate?
The molecular formula of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate is C14H9N3O7.
What is the molecular weight of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate?
The molecular weight of [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate is 331.04 g/mol.
Where can I buy [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate?
You can request a quote for [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [3-(Hydroxyiminomethyl)phenyl] 3,5-dinitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.