N-(2-氯乙基)-N-(2-甲氧乙基)苄胺
TL;DR: N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 (CAS 50283-06-2) is a chemical compound with molecular formula C12H18ClNO and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-氯乙基)-N-(2-甲氧乙基)苄胺
N-benzyl-N-(2-chloroethyl)-2-methoxyethanamine
Also Known As: N-(2-Methoxyethyl)-N-benzyl-2-chloroethylamine, N-(2-Chloroethyl)-N-(2-methoxyethyl)benzylamine, BENZYLAMINE, N-(2-CHLOROETHYL)-N-(2-METHOXYETHYL)-, benzyl(2-chloroethyl)(2-methoxyethyl)amine, N-benzyl-N-(2-chloroethyl)-2-methoxyethanamine
| Molecular Formula | C12H18ClNO |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 227.1077 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 50283-06-2 |
|---|---|
| SMILES | COCCN(CCCl)CC1=CC=CC=C1 |
| InChIKey | GVSPFGGUBVUVMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 (CAS 50283-06-2), with molecular formula C12H18ClNO and molecular weight 227.11 g/mol. IUPAC: N-benzyl-N-(2-chloroethyl)-2-methoxyethanamine.
Chemical Property Profile of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺
Property Insights of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-氯乙基)-N-(2-甲氧乙基)苄胺. With a topological polar surface area (TPSA) of 12.5 Ų, N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 has 0 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 N-(2-氯乙基)-N-(2-甲氧乙基)苄胺?
The CAS number of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 is 50283-06-2.
What is the molecular formula of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺?
The molecular formula of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 is C12H18ClNO.
What is the molecular weight of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺?
The molecular weight of N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 is 227.11 g/mol.
Where can I buy N-(2-氯乙基)-N-(2-甲氧乙基)苄胺?
You can request a quote for N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-氯乙基)-N-(2-甲氧乙基)苄胺?
Yes, KEHONG BIO provides custom synthesis services for N-(2-氯乙基)-N-(2-甲氧乙基)苄胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.