(3,4,5-Trimethoxy-2-nitrophenyl)methanol
TL;DR: (3,4,5-Trimethoxy-2-nitrophenyl)methanol (CAS 6296-32-8) is a chemical compound with molecular formula C10H13NO6 and molecular weight 243.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,5-trimethoxy-2-nitrophenyl)methanol
Also Known As: (3,4,5-trimethoxy-2-nitrophenyl)methanol, KST-1A6750, 3,4,5-trimethoxy-2-nitrobenzyl alcohol, Benzenemethanol, 3,4,5-trimethoxy-2-nitro-, 2-Nitro-3,4,5-trimethoxybenzenemethanol
| Molecular Formula | C10H13NO6 |
|---|---|
| Molecular Weight | 243.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.07428 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 6296-32-8 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)CO)[N+](=O)[O-])OC)OC |
| InChIKey | QUYJMJKAYOXDOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,4,5-Trimethoxy-2-nitrophenyl)methanol (CAS 6296-32-8), with molecular formula C10H13NO6 and molecular weight 243.07 g/mol. IUPAC: (3,4,5-trimethoxy-2-nitrophenyl)methanol.
Chemical Property Profile of (3,4,5-Trimethoxy-2-nitrophenyl)methanol
Property Insights of (3,4,5-Trimethoxy-2-nitrophenyl)methanol
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4,5-Trimethoxy-2-nitrophenyl)methanol. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,4,5-Trimethoxy-2-nitrophenyl)methanol. Following Lipinski's Rule of Five, (3,4,5-Trimethoxy-2-nitrophenyl)methanol has 1 hydrogen bond donor(s) and 6 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 (3,4,5-Trimethoxy-2-nitrophenyl)methanol?
The CAS number of (3,4,5-Trimethoxy-2-nitrophenyl)methanol is 6296-32-8.
What is the molecular formula of (3,4,5-Trimethoxy-2-nitrophenyl)methanol?
The molecular formula of (3,4,5-Trimethoxy-2-nitrophenyl)methanol is C10H13NO6.
What is the molecular weight of (3,4,5-Trimethoxy-2-nitrophenyl)methanol?
The molecular weight of (3,4,5-Trimethoxy-2-nitrophenyl)methanol is 243.07 g/mol.
Where can I buy (3,4,5-Trimethoxy-2-nitrophenyl)methanol?
You can request a quote for (3,4,5-Trimethoxy-2-nitrophenyl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4,5-Trimethoxy-2-nitrophenyl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (3,4,5-Trimethoxy-2-nitrophenyl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.