Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-
TL;DR: Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- (CAS 64061-59-2) is a chemical compound with molecular formula C10H11NO3 and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylprop-1-enyl)-6-nitrophenol
Also Known As: 2-(2-Methyl-1-propenyl)-6-nitrophenol, Phenol, 2-(2-methyl-1-propenyl)-6-nitro-, 2-(2-methylprop-1-enyl)-6-nitrophenol, Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-, 2-(2-METHYLPROP-1-EN-1-YL)-6-NITROPHENOL
| Molecular Formula | C10H11NO3 |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.0739 |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 64061-59-2 |
|---|---|
| SMILES | CC(=CC1=C(C(=CC=C1)[N+](=O)[O-])O)C |
| InChIKey | KELSIGSZYNCJKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- (CAS 64061-59-2), with molecular formula C10H11NO3 and molecular weight 193.07 g/mol. IUPAC: 2-(2-methylprop-1-enyl)-6-nitrophenol.
Chemical Property Profile of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-
Property Insights of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-
The XLogP value of 3.6 indicates that Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-. Following Lipinski's Rule of Five, Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- 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 Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-?
The CAS number of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- is 64061-59-2.
What is the molecular formula of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-?
The molecular formula of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- is C10H11NO3.
What is the molecular weight of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-?
The molecular weight of Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- is 193.07 g/mol.
Where can I buy Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-?
You can request a quote for Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2-(2-methyl-1-propen-1-yl)-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.