N-苄基-N-乙基-2-氯乙胺
TL;DR: N-苄基-N-乙基-2-氯乙胺 (CAS 60154-59-8) is a chemical compound with molecular formula C11H16ClN and molecular weight 197.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄基-N-乙基-2-氯乙胺
N-benzyl-2-chloro-N-ethylethanamine
Also Known As: N-benzyl-2-chloro-N-ethylethanamine, Benzenemethanamine, N-(2-chloroethyl)-N-ethyl-, N-benzyl-N-ethyl-2-chloroethylamine, Aethyl-benzyl-(2-chlor-aethyl)-amin, benzyl-(2-chloro-ethyl)-ethyl-amine
| Molecular Formula | C11H16ClN |
|---|---|
| Molecular Weight | 197.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 197.09712 |
| Heavy Atoms | 13 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 60154-59-8 |
|---|---|
| SMILES | CCN(CCCl)CC1=CC=CC=C1 |
| InChIKey | PEDYEFUCMXSQJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-苄基-N-乙基-2-氯乙胺 (CAS 60154-59-8), with molecular formula C11H16ClN and molecular weight 197.10 g/mol. IUPAC: N-benzyl-2-chloro-N-ethylethanamine.
Chemical Property Profile of N-苄基-N-乙基-2-氯乙胺
Property Insights of N-苄基-N-乙基-2-氯乙胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-苄基-N-乙基-2-氯乙胺. With a topological polar surface area (TPSA) of 3.2 Ų, N-苄基-N-乙基-2-氯乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-苄基-N-乙基-2-氯乙胺 has 0 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 N-苄基-N-乙基-2-氯乙胺?
The CAS number of N-苄基-N-乙基-2-氯乙胺 is 60154-59-8.
What is the molecular formula of N-苄基-N-乙基-2-氯乙胺?
The molecular formula of N-苄基-N-乙基-2-氯乙胺 is C11H16ClN.
What is the molecular weight of N-苄基-N-乙基-2-氯乙胺?
The molecular weight of N-苄基-N-乙基-2-氯乙胺 is 197.10 g/mol.
Where can I buy N-苄基-N-乙基-2-氯乙胺?
You can request a quote for N-苄基-N-乙基-2-氯乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄基-N-乙基-2-氯乙胺?
Yes, KEHONG BIO provides custom synthesis services for N-苄基-N-乙基-2-氯乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.