9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one
TL;DR: 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one (CAS 327097-46-1) is a chemical compound with molecular formula C18H13NO6 and molecular weight 339.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methyl-8-(4-nitrophenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one
Also Known As: 9-methyl-8-(4-nitrophenyl)-2H-[1,4]dioxino[2,3-h]chromen-7(3H)-one, 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one, 9-methyl-8-(4-nitrophenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one
| Molecular Formula | C18H13NO6 |
|---|---|
| Molecular Weight | 339.07 g/mol |
| LogP | 3.44782 |
| Topological Polar Surface Area | 91.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.07428 |
| Heavy Atoms | 25 |
| Complexity | 1051.8347 |
Chemical Identifiers
| CAS Number | 327097-46-1 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(O1)C3=C(C=C2)OCCO3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one (CAS 327097-46-1), with molecular formula C18H13NO6 and molecular weight 339.07 g/mol. IUPAC: 9-methyl-8-(4-nitrophenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one.
Chemical Property Profile of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one
Property Insights of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one
The XLogP value of 3.44782 indicates that 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one. Following Lipinski's Rule of Five, 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one has 0 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 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one?
The CAS number of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one is 327097-46-1.
What is the molecular formula of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one?
The molecular formula of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one is C18H13NO6.
What is the molecular weight of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one?
The molecular weight of 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one is 339.07 g/mol.
Where can I buy 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one?
You can request a quote for 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one?
Yes, KEHONG BIO provides custom synthesis services for 9-methyl-8-(4-nitrophenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.