3-(4-Chloro-3-nitrophenyl)propan-1-amine
TL;DR: 3-(4-Chloro-3-nitrophenyl)propan-1-amine (CAS 854692-82-3) is a chemical compound with molecular formula C9H11ClN2O2 and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-3-nitrophenyl)propan-1-amine
Also Known As: 3-(4-chloro-3-nitrophenyl)propan-1-amine, 3-(4-chloro-3-nitro-phenyl)propan-1-amine
| Molecular Formula | C9H11ClN2O2 |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 2.1395 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.0509 |
| Heavy Atoms | 14 |
| Complexity | 341.5839 |
Chemical Identifiers
| CAS Number | 854692-82-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1CCCN)[N+](=O)[O-])Cl |
Product Overview
3-(4-Chloro-3-nitrophenyl)propan-1-amine (CAS 854692-82-3), with molecular formula C9H11ClN2O2 and molecular weight 214.05 g/mol. IUPAC: 3-(4-chloro-3-nitrophenyl)propan-1-amine.
Chemical Property Profile of 3-(4-Chloro-3-nitrophenyl)propan-1-amine
Property Insights of 3-(4-Chloro-3-nitrophenyl)propan-1-amine
The XLogP value of 2.1395 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chloro-3-nitrophenyl)propan-1-amine. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chloro-3-nitrophenyl)propan-1-amine. Following Lipinski's Rule of Five, 3-(4-Chloro-3-nitrophenyl)propan-1-amine has 1 hydrogen bond donor(s) and 3 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 3-(4-Chloro-3-nitrophenyl)propan-1-amine?
The CAS number of 3-(4-Chloro-3-nitrophenyl)propan-1-amine is 854692-82-3.
What is the molecular formula of 3-(4-Chloro-3-nitrophenyl)propan-1-amine?
The molecular formula of 3-(4-Chloro-3-nitrophenyl)propan-1-amine is C9H11ClN2O2.
What is the molecular weight of 3-(4-Chloro-3-nitrophenyl)propan-1-amine?
The molecular weight of 3-(4-Chloro-3-nitrophenyl)propan-1-amine is 214.05 g/mol.
Where can I buy 3-(4-Chloro-3-nitrophenyl)propan-1-amine?
You can request a quote for 3-(4-Chloro-3-nitrophenyl)propan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chloro-3-nitrophenyl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chloro-3-nitrophenyl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.