Benzenemethanamine, 3,5-dichloro-N-ethyl-
TL;DR: Benzenemethanamine, 3,5-dichloro-N-ethyl- (CAS 90390-22-0) is a chemical compound with molecular formula C9H11Cl2N and molecular weight 203.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dichlorophenyl)methyl]ethanamine
Also Known As: Benzylamine der, Benzenemethanamine, 3,5-dichloro-N-ethyl-, Ethyl(3,5-dichlorobenzyl)amine, N-[(3,5-dichlorophenyl)methyl]ethanamine, 3,5-DICHLORO-N-ETHYL-BENZENEMETHANAMINE
| Molecular Formula | C9H11Cl2N |
|---|---|
| Molecular Weight | 203.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.02686 |
| Heavy Atoms | 12 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 90390-22-0 |
|---|---|
| SMILES | CCNCC1=CC(=CC(=C1)Cl)Cl |
| InChIKey | KYTXJFGXFLEWJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanamine, 3,5-dichloro-N-ethyl- (CAS 90390-22-0), with molecular formula C9H11Cl2N and molecular weight 203.03 g/mol. IUPAC: N-[(3,5-dichlorophenyl)methyl]ethanamine.
Chemical Property Profile of Benzenemethanamine, 3,5-dichloro-N-ethyl-
Property Insights of Benzenemethanamine, 3,5-dichloro-N-ethyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, 3,5-dichloro-N-ethyl-. With a topological polar surface area (TPSA) of 12.0 Ų, Benzenemethanamine, 3,5-dichloro-N-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, 3,5-dichloro-N-ethyl- has 1 hydrogen bond donor(s) and 1 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 Benzenemethanamine, 3,5-dichloro-N-ethyl-?
The CAS number of Benzenemethanamine, 3,5-dichloro-N-ethyl- is 90390-22-0.
What is the molecular formula of Benzenemethanamine, 3,5-dichloro-N-ethyl-?
The molecular formula of Benzenemethanamine, 3,5-dichloro-N-ethyl- is C9H11Cl2N.
What is the molecular weight of Benzenemethanamine, 3,5-dichloro-N-ethyl-?
The molecular weight of Benzenemethanamine, 3,5-dichloro-N-ethyl- is 203.03 g/mol.
Where can I buy Benzenemethanamine, 3,5-dichloro-N-ethyl-?
You can request a quote for Benzenemethanamine, 3,5-dichloro-N-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, 3,5-dichloro-N-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, 3,5-dichloro-N-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.