Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride
TL;DR: Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride (CAS 64012-01-7) is a chemical compound with molecular formula C11H17Cl2NO and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl-[(2-methoxyphenyl)methyl]-methylazanium chloride
Also Known As: N-(2-Chloromethyl)-2-methoxy-N-methylbenzylamine hydrochloride, BENZYLAMINE, N-(2-CHLOROETHYL)-o-METHOXY-N-METHYL-, HYDROCHLORIDE, 2-chloroethyl-[(2-methoxyphenyl)methyl]-methylazanium chloride, N-(2-Chloromethyl)-o-methoxy-N-methylbenzylamine hydrochloride, Benzenemethanamine, N-(2-chloroethyl)-2-methoxy-N-methyl-, hydrochloride
| Molecular Formula | C11H17Cl2NO |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | -2.05 |
| Topological Polar Surface Area | 13.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.06873 |
| Heavy Atoms | 15 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 64012-01-7 |
|---|---|
| SMILES | C[NH+](CCCl)CC1=CC=CC=C1OC.[Cl-] |
| InChIKey | LBLYFTCYYCQVLG-UHFFFAOYSA-N |
Product Overview
Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride (CAS 64012-01-7), with molecular formula C11H17Cl2NO and molecular weight 249.07 g/mol. IUPAC: 2-chloroethyl-[(2-methoxyphenyl)methyl]-methylazanium chloride.
Chemical Property Profile of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride
Property Insights of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride
The XLogP value of -2.05 indicates that Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.7 Ų, Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride 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 Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride?
The CAS number of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride is 64012-01-7.
What is the molecular formula of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride?
The molecular formula of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride is C11H17Cl2NO.
What is the molecular weight of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride?
The molecular weight of Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride is 249.07 g/mol.
Where can I buy Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride?
You can request a quote for Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.