3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine
TL;DR: 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine (CAS 861408-37-9) is a chemical compound with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]propan-1-amine
Also Known As: 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine, N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]propan-1-amine, N-[(3-chloro-5-methoxy-4-prop-2-enoxy-phenyl)methyl]propan-1-amine, N-({3-Chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)propan-1-amine
| Molecular Formula | C14H20ClNO2 |
|---|---|
| Molecular Weight | 269.12 g/mol |
| LogP | 3.413 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 269.11826 |
| Heavy Atoms | 18 |
| Complexity | 393.62555 |
Chemical Identifiers
| CAS Number | 861408-37-9 |
|---|---|
| SMILES | CCCNCC1=CC(=C(C(=C1)Cl)OCC=C)OC |
Product Overview
3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine (CAS 861408-37-9), with molecular formula C14H20ClNO2 and molecular weight 269.12 g/mol. IUPAC: N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]propan-1-amine.
Chemical Property Profile of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine
Property Insights of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine
The XLogP value of 3.413 indicates that 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine 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 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine?
The CAS number of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine is 861408-37-9.
What is the molecular formula of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine?
The molecular formula of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine is C14H20ClNO2.
What is the molecular weight of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine?
The molecular weight of 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine is 269.12 g/mol.
Where can I buy 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine?
You can request a quote for 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-5-methoxy-4-(2-propen-1-yloxy)-N-propylbenzenemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.