8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
TL;DR: 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] (CAS 82860-94-4) is a chemical compound with molecular formula C17H14N2O5 and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8'-methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
Also Known As: 8'-methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene], 8'-methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chrom, 8-Methoxy-3'-methyl-6-nitro-3'H-spiro[[1]benzopyran-2,2'-[1,3]benzoxazole]
| Molecular Formula | C17H14N2O5 |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.09027 |
| Heavy Atoms | 24 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 82860-94-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2OC13C=CC4=C(O3)C(=CC(=C4)[N+](=O)[O-])OC |
| InChIKey | UIMUWQDVRLHOEW-UHFFFAOYSA-N |
Product Overview
8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] (CAS 82860-94-4), with molecular formula C17H14N2O5 and molecular weight 326.09 g/mol. IUPAC: 8'-methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene].
Chemical Property Profile of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
Property Insights of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
The XLogP value of 3.7 indicates that 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]. Following Lipinski's Rule of Five, 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] 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 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The CAS number of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is 82860-94-4.
What is the molecular formula of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The molecular formula of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is C17H14N2O5.
What is the molecular weight of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The molecular weight of 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is 326.09 g/mol.
Where can I buy 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
You can request a quote for 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
Yes, KEHONG BIO provides custom synthesis services for 8'-Methoxy-3-methyl-6'-nitrospiro[1,3-benzoxazole-2,2'-chromene] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.