2',4'-Dihydroxy-5'-nitroacetophenone
TL;DR: 2',4'-Dihydroxy-5'-nitroacetophenone (CAS 38115-21-8) is a chemical compound with molecular formula C8H7NO5 and molecular weight 197.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dihydroxy-5-nitrophenyl)ethanone
Also Known As: 1-(2,4-dihydroxy-5-nitrophenyl)ethanone, 2',4'-Dihydroxy-5'-nitroacetophenone, 2,4-dihydroxy-5-nitroacetophenone, KST-1B3785, Ethanone,1-(2,4-dihydroxy-5-nitrophenyl)-
| Molecular Formula | C8H7NO5 |
|---|---|
| Molecular Weight | 197.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.03242 |
| Heavy Atoms | 14 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 38115-21-8 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1O)O)[N+](=O)[O-] |
| InChIKey | YDIKNQXUAAPWCX-UHFFFAOYSA-N |
Product Overview
2',4'-Dihydroxy-5'-nitroacetophenone (CAS 38115-21-8), with molecular formula C8H7NO5 and molecular weight 197.03 g/mol. IUPAC: 1-(2,4-dihydroxy-5-nitrophenyl)ethanone.
Chemical Property Profile of 2',4'-Dihydroxy-5'-nitroacetophenone
Property Insights of 2',4'-Dihydroxy-5'-nitroacetophenone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',4'-Dihydroxy-5'-nitroacetophenone. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2',4'-Dihydroxy-5'-nitroacetophenone. Following Lipinski's Rule of Five, 2',4'-Dihydroxy-5'-nitroacetophenone has 2 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 2',4'-Dihydroxy-5'-nitroacetophenone?
The CAS number of 2',4'-Dihydroxy-5'-nitroacetophenone is 38115-21-8.
What is the molecular formula of 2',4'-Dihydroxy-5'-nitroacetophenone?
The molecular formula of 2',4'-Dihydroxy-5'-nitroacetophenone is C8H7NO5.
What is the molecular weight of 2',4'-Dihydroxy-5'-nitroacetophenone?
The molecular weight of 2',4'-Dihydroxy-5'-nitroacetophenone is 197.03 g/mol.
Where can I buy 2',4'-Dihydroxy-5'-nitroacetophenone?
You can request a quote for 2',4'-Dihydroxy-5'-nitroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',4'-Dihydroxy-5'-nitroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2',4'-Dihydroxy-5'-nitroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.