![3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane structure](/static/products/7300/73004-96-3.webp)
3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane
TL;DR: 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane (CAS 73004-96-3) is a chemical compound with molecular formula C10H17NO4 and molecular weight 215.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-3-nitro-1,5-dioxaspiro[5.5]undecane
Also Known As: 3-methyl-3-nitro-1,5-dioxaspiro[5.5]undecane, 1,5-Dioxaspiro[5.5]undecane, 3-methyl-3-nitro-, 3-Methyl-3-nitro-1,5-dioxa-spiro[5.5]undecane, 9-methyl-9-nitro-7,11-dioxaspiro[5.5]undecane
| Molecular Formula | C10H17NO4 |
|---|---|
| Molecular Weight | 215.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.11575 |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 73004-96-3 |
|---|---|
| SMILES | CC1(COC2(CCCCC2)OC1)[N+](=O)[O-] |
| InChIKey | QZSNNLGSVONIEG-UHFFFAOYSA-N |
Product Overview
3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane (CAS 73004-96-3), with molecular formula C10H17NO4 and molecular weight 215.12 g/mol. IUPAC: 3-methyl-3-nitro-1,5-dioxaspiro[5.5]undecane.
Chemical Property Profile of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane
Property Insights of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane. Following Lipinski's Rule of Five, 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane has 0 hydrogen bond donor(s) and 4 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 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane?
The CAS number of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane is 73004-96-3.
What is the molecular formula of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane?
The molecular formula of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane is C10H17NO4.
What is the molecular weight of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane?
The molecular weight of 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane is 215.12 g/mol.
Where can I buy 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane?
You can request a quote for 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3-nitro-1,5-dioxaspiro[5.5]undecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.