2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-
TL;DR: 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- (CAS 54774-80-0) is a chemical compound with molecular formula C7H7NO5 and molecular weight 185.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-6-methyl-3-nitropyran-2-one
Also Known As: 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-, 4-Methoxy-6-methyl-3-nitro-2H-pyran-2-one, 4-methoxy-6-methyl-3-nitropyran-2-one, 4-methoxy-6-methyl-3-nitro-pyran-2-one, 3-Nitro-4-methoxy-6-methyl-2H-pyran-2-one
| Molecular Formula | C7H7NO5 |
|---|---|
| Molecular Weight | 185.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.03242 |
| Heavy Atoms | 13 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 54774-80-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=O)O1)[N+](=O)[O-])OC |
| InChIKey | SEVAYKDUQQGCNA-UHFFFAOYSA-N |
Product Overview
2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- (CAS 54774-80-0), with molecular formula C7H7NO5 and molecular weight 185.03 g/mol. IUPAC: 4-methoxy-6-methyl-3-nitropyran-2-one.
Chemical Property Profile of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-
Property Insights of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-. Following Lipinski's Rule of Five, 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- has 0 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 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-?
The CAS number of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- is 54774-80-0.
What is the molecular formula of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-?
The molecular formula of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- is C7H7NO5.
What is the molecular weight of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-?
The molecular weight of 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- is 185.03 g/mol.
Where can I buy 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-?
You can request a quote for 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Pyran-2-one, 4-methoxy-6-methyl-3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.