N-(α-(硝基乙基)苄基)乙二胺
TL;DR: N-(α-(硝基乙基)苄基)乙二胺 (CAS 14762-38-0) is a chemical compound with molecular formula C11H17N3O2 and molecular weight 223.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(α-(硝基乙基)苄基)乙二胺
N'-(2-nitro-1-phenylpropyl)ethane-1,2-diamine
Also Known As: N-(2-Nitro-1-phenylpropyl)ethylenediamine, N-(1-Phenyl-2-nitropropyl)ethylenediamine, 1,2-Ethanediamine, N-(2-nitro-1-phenylpropyl)-, N-(ALPHA-(NITROETHYL)BENZYL) ETHYLENEDIAMINE, 1,2-Ethanediamine, N1-(2-nitro-1-phenylpropyl)-
| Molecular Formula | C11H17N3O2 |
|---|---|
| Molecular Weight | 223.13 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.13208 |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 14762-38-0 |
|---|---|
| SMILES | CC(C(C1=CC=CC=C1)NCCN)[N+](=O)[O-] |
| InChIKey | KHUHJMXIOOBDQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(α-(硝基乙基)苄基)乙二胺 (CAS 14762-38-0), with molecular formula C11H17N3O2 and molecular weight 223.13 g/mol. IUPAC: N'-(2-nitro-1-phenylpropyl)ethane-1,2-diamine.
Chemical Property Profile of N-(α-(硝基乙基)苄基)乙二胺
Property Insights of N-(α-(硝基乙基)苄基)乙二胺
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(α-(硝基乙基)苄基)乙二胺. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(α-(硝基乙基)苄基)乙二胺. Following Lipinski's Rule of Five, N-(α-(硝基乙基)苄基)乙二胺 has 2 hydrogen bond donor(s) and 4 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-(α-(硝基乙基)苄基)乙二胺?
The CAS number of N-(α-(硝基乙基)苄基)乙二胺 is 14762-38-0.
What is the molecular formula of N-(α-(硝基乙基)苄基)乙二胺?
The molecular formula of N-(α-(硝基乙基)苄基)乙二胺 is C11H17N3O2.
What is the molecular weight of N-(α-(硝基乙基)苄基)乙二胺?
The molecular weight of N-(α-(硝基乙基)苄基)乙二胺 is 223.13 g/mol.
Where can I buy N-(α-(硝基乙基)苄基)乙二胺?
You can request a quote for N-(α-(硝基乙基)苄基)乙二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(α-(硝基乙基)苄基)乙二胺?
Yes, KEHONG BIO provides custom synthesis services for N-(α-(硝基乙基)苄基)乙二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.