6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
TL;DR: 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] (CAS 33442-78-3) is a chemical compound with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
Also Known As: 6'-methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene], 6'-methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-, 6-Methoxy-3,3'-dimethyl-8-nitro-3'H-spiro[[1]benzopyran-2,2'-[1,3]benzoxazole]
| Molecular Formula | C18H16N2O5 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 340.10593 |
| Heavy Atoms | 25 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 33442-78-3 |
|---|---|
| SMILES | CC1=CC2=C(C(=CC(=C2)OC)[N+](=O)[O-])OC13N(C4=CC=CC=C4O3)C |
| InChIKey | GZOFKEKQXPRPPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] (CAS 33442-78-3), with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol. IUPAC: 6'-methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene].
Chemical Property Profile of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
Property Insights of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]
The XLogP value of 3.6 indicates that 6'-Methoxy-3,3'-dimethyl-8'-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 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]. Following Lipinski's Rule of Five, 6'-Methoxy-3,3'-dimethyl-8'-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 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The CAS number of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is 33442-78-3.
What is the molecular formula of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The molecular formula of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is C18H16N2O5.
What is the molecular weight of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
The molecular weight of 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] is 340.11 g/mol.
Where can I buy 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
You can request a quote for 6'-Methoxy-3,3'-dimethyl-8'-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 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene]?
Yes, KEHONG BIO provides custom synthesis services for 6'-Methoxy-3,3'-dimethyl-8'-nitrospiro[1,3-benzoxazole-2,2'-chromene] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.