3-Propoxyaniline
TL;DR: 3-Propoxyaniline (CAS 312708-27-3) is a chemical compound with molecular formula C9H13NO and molecular weight 151.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propoxyaniline
Also Known As: 3-propoxyaniline, 3-Propoxy-phenylamine, 3-propoxybenzenamine, 3-propoxyphenylamine, m-n-propoxy-aniline
| Molecular Formula | C9H13NO |
|---|---|
| Molecular Weight | 151.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 151.09972 |
| Heavy Atoms | 11 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 312708-27-3 |
|---|---|
| SMILES | CCCOC1=CC=CC(=C1)N |
| InChIKey | VPAHCDXFLUSULH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Propoxyaniline (CAS 312708-27-3), with molecular formula C9H13NO and molecular weight 151.10 g/mol. IUPAC: 3-propoxyaniline.
Chemical Property Profile of 3-Propoxyaniline
Property Insights of 3-Propoxyaniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Propoxyaniline. With a topological polar surface area (TPSA) of 35.3 Ų, 3-Propoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Propoxyaniline has 1 hydrogen bond donor(s) and 2 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-Propoxyaniline?
The CAS number of 3-Propoxyaniline is 312708-27-3.
What is the molecular formula of 3-Propoxyaniline?
The molecular formula of 3-Propoxyaniline is C9H13NO.
What is the molecular weight of 3-Propoxyaniline?
The molecular weight of 3-Propoxyaniline is 151.10 g/mol.
Where can I buy 3-Propoxyaniline?
You can request a quote for 3-Propoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Propoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Propoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.