2-硝基-1-苯基丙烷
TL;DR: 2-硝基-1-苯基丙烷 (CAS 17322-34-8) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-硝基-1-苯基丙烷
2-nitropropylbenzene
Also Known As: 2-nitropropylbenzene, 2-Nitro-1-phenylpropane, (2-Nitropropyl)benzene, 1-Phenyl-2-nitropropane, 2-nitropropyl)benzene
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.07898 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 17322-34-8 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)[N+](=O)[O-] |
| InChIKey | OQBJLKIDAPUHSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-硝基-1-苯基丙烷 (CAS 17322-34-8), with molecular formula C9H11NO2 and molecular weight 165.08 g/mol. IUPAC: 2-nitropropylbenzene.
Chemical Property Profile of 2-硝基-1-苯基丙烷
Property Insights of 2-硝基-1-苯基丙烷
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-硝基-1-苯基丙烷. With a topological polar surface area (TPSA) of 45.8 Ų, 2-硝基-1-苯基丙烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-硝基-1-苯基丙烷 has 0 hydrogen bond donor(s) and 2 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 2-硝基-1-苯基丙烷?
The CAS number of 2-硝基-1-苯基丙烷 is 17322-34-8.
What is the molecular formula of 2-硝基-1-苯基丙烷?
The molecular formula of 2-硝基-1-苯基丙烷 is C9H11NO2.
What is the molecular weight of 2-硝基-1-苯基丙烷?
The molecular weight of 2-硝基-1-苯基丙烷 is 165.08 g/mol.
Where can I buy 2-硝基-1-苯基丙烷?
You can request a quote for 2-硝基-1-苯基丙烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-硝基-1-苯基丙烷?
Yes, KEHONG BIO provides custom synthesis services for 2-硝基-1-苯基丙烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.