![3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline structure](/static/products/9304/93042-47-8.webp)
3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline
TL;DR: 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline (CAS 93042-47-8) is a chemical compound with molecular formula C12H19ClN2O2 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline
Also Known As: 3-chloro-4-(3-dimethylaminopropoxy)-5-methoxy-aniline, 3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline, Benzenamine, 3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxy-
| Molecular Formula | C12H19ClN2O2 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 47.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 258.1135 |
| Heavy Atoms | 17 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 93042-47-8 |
|---|---|
| SMILES | CN(C)CCCOC1=C(C=C(C=C1Cl)N)OC |
| InChIKey | YRCIIGPZHGSSLS-UHFFFAOYSA-N |
Product Overview
3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline (CAS 93042-47-8), with molecular formula C12H19ClN2O2 and molecular weight 258.11 g/mol. IUPAC: 3-chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline.
Chemical Property Profile of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline
Property Insights of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline. With a topological polar surface area (TPSA) of 47.7 Ų, 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline 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 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline?
The CAS number of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline is 93042-47-8.
What is the molecular formula of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline?
The molecular formula of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline is C12H19ClN2O2.
What is the molecular weight of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline?
The molecular weight of 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline is 258.11 g/mol.
Where can I buy 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline?
You can request a quote for 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-[3-(dimethylamino)propoxy]-5-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.