(4-Chloro-2-methyl-3,5-dinitrophenyl)methanol
TL;DR: (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol (CAS 72908-02-2) is a chemical compound with molecular formula C8H7ClN2O5 and molecular weight 246.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-2-methyl-3,5-dinitrophenyl)methanol
Also Known As: (4-chloro-2-methyl-3,5-dinitrophenyl)methanol, 4-chloro-2-methyl-3,5-dinitrobenzyl alcohol, (4-chloro-2-methyl-3,5-dinitro-phenyl)methanol, 850-447-8, RefChem:402604
| Molecular Formula | C8H7ClN2O5 |
|---|---|
| Molecular Weight | 246.00 g/mol |
| LogP | 1.95712 |
| Topological Polar Surface Area | 106.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.00435 |
| Heavy Atoms | 16 |
| Complexity | 473.98676 |
Chemical Identifiers
| CAS Number | 72908-02-2 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1CO)[N+](=O)[O-])Cl)[N+](=O)[O-] |
Product Overview
(4-Chloro-2-methyl-3,5-dinitrophenyl)methanol (CAS 72908-02-2), with molecular formula C8H7ClN2O5 and molecular weight 246.00 g/mol. IUPAC: (4-chloro-2-methyl-3,5-dinitrophenyl)methanol.
Chemical Property Profile of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol
Property Insights of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol
The XLogP value of 1.95712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol. The TPSA of 106.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol. Following Lipinski's Rule of Five, (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol 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 (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol?
The CAS number of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol is 72908-02-2.
What is the molecular formula of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol?
The molecular formula of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol is C8H7ClN2O5.
What is the molecular weight of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol?
The molecular weight of (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol is 246.00 g/mol.
Where can I buy (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol?
You can request a quote for (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (4-Chloro-2-methyl-3,5-dinitrophenyl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.