3-Chloro-4-methoxybenzylamine hydrochloride
TL;DR: 3-Chloro-4-methoxybenzylamine hydrochloride (CAS 115514-77-7) is a chemical compound with molecular formula C8H11Cl2NO and molecular weight 207.02177 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-chloro-4-methoxyphenyl)methanamine;hydrochloride
Also Known As: 3-Chloro-4-methoxybenzylamine hydrochloride, (3-chloro-4-methoxyphenyl)methanamine hydrochloride, Avanafil Impurity 54, 3-Chloro-4-methoxybenzylamine HCl, 3-chloro-4-methoxybenzylamine.HCl
Technical Specifications
| Molecular Formula | C8H11Cl2NO |
| Molecular Weight | 207.02177 g/mol |
| XLogP | 2.2291 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.02177 Da |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
| SMILES | COC1=C(C=C(C=C1)CN)Cl.Cl |
| InChIKey | IKWWOZCEHOYKAO-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloro-4-methoxybenzylamine hydrochloride
Property Insights of 3-Chloro-4-methoxybenzylamine hydrochloride
The XLogP value of 2.2291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-4-methoxybenzylamine hydrochloride. With a topological polar surface area (TPSA) of 35.3 Ų, 3-Chloro-4-methoxybenzylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-methoxybenzylamine hydrochloride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Chloro-4-methoxybenzylamine hydrochloride?
The CAS number of 3-Chloro-4-methoxybenzylamine hydrochloride is 115514-77-7.
What is the molecular formula of 3-Chloro-4-methoxybenzylamine hydrochloride?
The molecular formula of 3-Chloro-4-methoxybenzylamine hydrochloride is C8H11Cl2NO.
What is the molecular weight of 3-Chloro-4-methoxybenzylamine hydrochloride?
The molecular weight of 3-Chloro-4-methoxybenzylamine hydrochloride is 207.02177 g/mol.
Where can I buy 3-Chloro-4-methoxybenzylamine hydrochloride?
You can request a quote for 3-Chloro-4-methoxybenzylamine hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloro-4-methoxybenzylamine hydrochloride?
Yes, CoreyChem provides custom synthesis services for 3-Chloro-4-methoxybenzylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.