1-(4-硝基苯基)丙-2-胺
TL;DR: 1-(4-硝基苯基)丙-2-胺 (CAS 13026-03-4) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-硝基苯基)丙-2-胺
1-(4-nitrophenyl)propan-2-amine
Also Known As: 1-(4-nitrophenyl)propan-2-amine, 1-(4'-nitro)phenyl-2-propanamine, 1-(4-Nitrophenyl)propane-2-amine, 1-p-nitrophenyl-2 [amino] propane, J3.017.257D
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 13026-03-4 |
|---|---|
| SMILES | CC(CC1=CC=C(C=C1)[N+](=O)[O-])N |
| InChIKey | CQVVPZKXDRZYBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-硝基苯基)丙-2-胺 (CAS 13026-03-4), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: 1-(4-nitrophenyl)propan-2-amine.
Chemical Property Profile of 1-(4-硝基苯基)丙-2-胺
Property Insights of 1-(4-硝基苯基)丙-2-胺
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-硝基苯基)丙-2-胺. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-硝基苯基)丙-2-胺. Following Lipinski's Rule of Five, 1-(4-硝基苯基)丙-2-胺 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 1-(4-硝基苯基)丙-2-胺?
The CAS number of 1-(4-硝基苯基)丙-2-胺 is 13026-03-4.
What is the molecular formula of 1-(4-硝基苯基)丙-2-胺?
The molecular formula of 1-(4-硝基苯基)丙-2-胺 is C9H12N2O2.
What is the molecular weight of 1-(4-硝基苯基)丙-2-胺?
The molecular weight of 1-(4-硝基苯基)丙-2-胺 is 180.09 g/mol.
Where can I buy 1-(4-硝基苯基)丙-2-胺?
You can request a quote for 1-(4-硝基苯基)丙-2-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-硝基苯基)丙-2-胺?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-硝基苯基)丙-2-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.