Phenol, 2,4-dinitro-6-propyl-
TL;DR: Phenol, 2,4-dinitro-6-propyl- (CAS 4099-72-3) is a chemical compound with molecular formula C9H10N2O5 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-6-propylphenol
Also Known As: 2,4-Dinitro-6-propylphenol, Phenol, 2,4-dinitro-6-propyl-, RefChem:368913
| Molecular Formula | C9H10N2O5 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 2.1611 |
| Topological Polar Surface Area | 106.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.05898 |
| Heavy Atoms | 16 |
| Complexity | 443.77063 |
Chemical Identifiers
| CAS Number | 4099-72-3 |
|---|---|
| SMILES | CCCC1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])O |
Product Overview
Phenol, 2,4-dinitro-6-propyl- (CAS 4099-72-3), with molecular formula C9H10N2O5 and molecular weight 226.06 g/mol. IUPAC: 2,4-dinitro-6-propylphenol.
Chemical Property Profile of Phenol, 2,4-dinitro-6-propyl-
Property Insights of Phenol, 2,4-dinitro-6-propyl-
The XLogP value of 2.1611 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 2,4-dinitro-6-propyl-. The TPSA of 106.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 2,4-dinitro-6-propyl-. Following Lipinski's Rule of Five, Phenol, 2,4-dinitro-6-propyl- has 1 hydrogen bond donor(s) and 5 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 Phenol, 2,4-dinitro-6-propyl-?
The CAS number of Phenol, 2,4-dinitro-6-propyl- is 4099-72-3.
What is the molecular formula of Phenol, 2,4-dinitro-6-propyl-?
The molecular formula of Phenol, 2,4-dinitro-6-propyl- is C9H10N2O5.
What is the molecular weight of Phenol, 2,4-dinitro-6-propyl-?
The molecular weight of Phenol, 2,4-dinitro-6-propyl- is 226.06 g/mol.
Where can I buy Phenol, 2,4-dinitro-6-propyl-?
You can request a quote for Phenol, 2,4-dinitro-6-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,4-dinitro-6-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,4-dinitro-6-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.