2-(Dimethoxymethyl)aniline
TL;DR: 2-(Dimethoxymethyl)aniline (CAS 71907-71-6) is a chemical compound with molecular formula C9H13NO2 and molecular weight 167.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethoxymethyl)aniline
Also Known As: 2-(Dimethoxymethyl)aniline, Aminobenzaldehyddimethylacetal, 2-(Dimethoxymethyl)aniline #, 1-(dimethoxymethyl)-2-aminobenzene, Benzene, 1-(dimethoxymethyl)-2-amino-
| Molecular Formula | C9H13NO2 |
|---|---|
| Molecular Weight | 167.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.09464 |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 71907-71-6 |
|---|---|
| SMILES | COC(C1=CC=CC=C1N)OC |
| InChIKey | YOSXXJYOJXPVFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Dimethoxymethyl)aniline (CAS 71907-71-6), with molecular formula C9H13NO2 and molecular weight 167.09 g/mol. IUPAC: 2-(dimethoxymethyl)aniline.
Chemical Property Profile of 2-(Dimethoxymethyl)aniline
Property Insights of 2-(Dimethoxymethyl)aniline
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethoxymethyl)aniline. With a topological polar surface area (TPSA) of 44.5 Ų, 2-(Dimethoxymethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethoxymethyl)aniline has 1 hydrogen bond donor(s) and 3 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 2-(Dimethoxymethyl)aniline?
The CAS number of 2-(Dimethoxymethyl)aniline is 71907-71-6.
What is the molecular formula of 2-(Dimethoxymethyl)aniline?
The molecular formula of 2-(Dimethoxymethyl)aniline is C9H13NO2.
What is the molecular weight of 2-(Dimethoxymethyl)aniline?
The molecular weight of 2-(Dimethoxymethyl)aniline is 167.09 g/mol.
Where can I buy 2-(Dimethoxymethyl)aniline?
You can request a quote for 2-(Dimethoxymethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethoxymethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethoxymethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.