N-(3-aminopropyl)-2-nitroaniline hydrochloride
TL;DR: N-(3-aminopropyl)-2-nitroaniline hydrochloride (CAS 145315-42-0) is a chemical compound with molecular formula C9H14ClN3O2 and molecular weight 231.07745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(2-nitrophenyl)propane-1,3-diamine;hydrochloride
Also Known As: N-(3-aminopropyl)-2-nitroaniline hydrochloride, BIM-0007522.P001, compound 1 [PMID: 15724976], N'-(2-nitrophenyl)propane-1,3-diamine;hydrochloride, N-(2-nitrophenyl)propane-1,3-diamine hydrochloride
Technical Specifications
| Molecular Formula | C9H14ClN3O2 |
| Molecular Weight | 231.07745 g/mol |
| XLogP | 1.7773 |
| Topological Polar Surface Area (TPSA) | 83.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.07745 Da |
| Heavy Atoms | 15 |
| Complexity | 181.0 |
| SMILES | C1=CC=C(C(=C1)NCCCN)[N+](=O)[O-].Cl |
| InChIKey | ZUGAQTRJRCXHQL-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-aminopropyl)-2-nitroaniline hydrochloride
Property Insights of N-(3-aminopropyl)-2-nitroaniline hydrochloride
The XLogP value of 1.7773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-aminopropyl)-2-nitroaniline hydrochloride. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-aminopropyl)-2-nitroaniline hydrochloride. Following Lipinski's Rule of Five, N-(3-aminopropyl)-2-nitroaniline hydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(3-aminopropyl)-2-nitroaniline hydrochloride?
The CAS number of N-(3-aminopropyl)-2-nitroaniline hydrochloride is 145315-42-0.
What is the molecular formula of N-(3-aminopropyl)-2-nitroaniline hydrochloride?
The molecular formula of N-(3-aminopropyl)-2-nitroaniline hydrochloride is C9H14ClN3O2.
What is the molecular weight of N-(3-aminopropyl)-2-nitroaniline hydrochloride?
The molecular weight of N-(3-aminopropyl)-2-nitroaniline hydrochloride is 231.07745 g/mol.
Where can I buy N-(3-aminopropyl)-2-nitroaniline hydrochloride?
You can request a quote for N-(3-aminopropyl)-2-nitroaniline hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-aminopropyl)-2-nitroaniline hydrochloride?
Yes, CoreyChem provides custom synthesis services for N-(3-aminopropyl)-2-nitroaniline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.