Benzaldehyde, 2,3-dimethoxy-, oxime
TL;DR: Benzaldehyde, 2,3-dimethoxy-, oxime (CAS 5470-95-1) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,3-dimethoxyphenyl)methylidene]hydroxylamine
Also Known As: 2,3-Dimethoxybenzaldoxime, 2,3-dimethoxybenzaldehyde oxime, o-Veratraldehyde, oxime, (Z)-2,3-Dimethoxybenzaldehyde oxime, Benzaldehyde, 2,3-dimethoxy-, oxime
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 5470-95-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C=NO |
| InChIKey | GKAIQNACVNFHCU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzaldehyde, 2,3-dimethoxy-, oxime (CAS 5470-95-1), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: N-[(2,3-dimethoxyphenyl)methylidene]hydroxylamine.
Chemical Property Profile of Benzaldehyde, 2,3-dimethoxy-, oxime
Property Insights of Benzaldehyde, 2,3-dimethoxy-, oxime
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde, 2,3-dimethoxy-, oxime. With a topological polar surface area (TPSA) of 51.1 Ų, Benzaldehyde, 2,3-dimethoxy-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzaldehyde, 2,3-dimethoxy-, oxime has 1 hydrogen bond donor(s) and 4 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 Benzaldehyde, 2,3-dimethoxy-, oxime?
The CAS number of Benzaldehyde, 2,3-dimethoxy-, oxime is 5470-95-1.
What is the molecular formula of Benzaldehyde, 2,3-dimethoxy-, oxime?
The molecular formula of Benzaldehyde, 2,3-dimethoxy-, oxime is C9H11NO3.
What is the molecular weight of Benzaldehyde, 2,3-dimethoxy-, oxime?
The molecular weight of Benzaldehyde, 2,3-dimethoxy-, oxime is 181.07 g/mol.
Where can I buy Benzaldehyde, 2,3-dimethoxy-, oxime?
You can request a quote for Benzaldehyde, 2,3-dimethoxy-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 2,3-dimethoxy-, oxime?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 2,3-dimethoxy-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.