![3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol structure](/static/products/2547/254747-56-3.webp)
3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol
TL;DR: 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol (CAS 254747-56-3) is a chemical compound with molecular formula C9H11ClN2O3 and molecular weight 230.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-nitroanilino)propan-1-ol
Also Known As: 3-[(5-chloro-2-nitrophenyl)amino]propan-1-ol, 3-(5-chloro-2-nitroanilino)propan-1-ol, BAS 00434767, 1-Propanol, 3-[(5-chloro-2-nitrophenyl)amino]-, 3-((5-Chloro-2-nitrophenyl)amino)propan-1-ol
| Molecular Formula | C9H11ClN2O3 |
|---|---|
| Molecular Weight | 230.05 g/mol |
| LogP | 2.0425 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 230.04582 |
| Heavy Atoms | 15 |
| Complexity | 357.21072 |
Chemical Identifiers
| CAS Number | 254747-56-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)NCCCO)[N+](=O)[O-] |
Product Overview
3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol (CAS 254747-56-3), with molecular formula C9H11ClN2O3 and molecular weight 230.05 g/mol. IUPAC: 3-(5-chloro-2-nitroanilino)propan-1-ol.
Chemical Property Profile of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol
Property Insights of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol
The XLogP value of 2.0425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol. Following Lipinski's Rule of Five, 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol 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 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol?
The CAS number of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol is 254747-56-3.
What is the molecular formula of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol?
The molecular formula of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol is C9H11ClN2O3.
What is the molecular weight of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol?
The molecular weight of 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol is 230.05 g/mol.
Where can I buy 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol?
You can request a quote for 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5-Chloro-2-nitrophenyl)amino]propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.