2-Nitro-1-phenyl-1-propanol
TL;DR: 2-Nitro-1-phenyl-1-propanol (CAS 72379-41-0) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-1-phenylpropan-1-ol
Also Known As: 2-nitro-1-phenylpropan-1-ol, 2-nitro-1-phenyl-1-propanol, starbld0012364, 1-phenyl-2-nitro-1-propanol, 1-Phenyl-2-nitro-propanol
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 72379-41-0 |
|---|---|
| SMILES | CC(C(C1=CC=CC=C1)O)[N+](=O)[O-] |
| InChIKey | JGYVPZIKTZGAAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Nitro-1-phenyl-1-propanol (CAS 72379-41-0), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: 2-nitro-1-phenylpropan-1-ol.
Chemical Property Profile of 2-Nitro-1-phenyl-1-propanol
Property Insights of 2-Nitro-1-phenyl-1-propanol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-1-phenyl-1-propanol. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-1-phenyl-1-propanol. Following Lipinski's Rule of Five, 2-Nitro-1-phenyl-1-propanol 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 2-Nitro-1-phenyl-1-propanol?
The CAS number of 2-Nitro-1-phenyl-1-propanol is 72379-41-0.
What is the molecular formula of 2-Nitro-1-phenyl-1-propanol?
The molecular formula of 2-Nitro-1-phenyl-1-propanol is C9H11NO3.
What is the molecular weight of 2-Nitro-1-phenyl-1-propanol?
The molecular weight of 2-Nitro-1-phenyl-1-propanol is 181.07 g/mol.
Where can I buy 2-Nitro-1-phenyl-1-propanol?
You can request a quote for 2-Nitro-1-phenyl-1-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitro-1-phenyl-1-propanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-1-phenyl-1-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.