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(3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate
TL;DR: (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate (CAS 34281-13-5) is a chemical compound with molecular formula C11H18N2O2 and molecular weight 210.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate
Also Known As: (3-methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate, 3-acetoxy-3-methyl-1,2-diaza-spiro[4.5]dec-1-ene, (2-methyl-3,4-diazaspiro[4.5]dec-3-en-2-yl) acetate, 3-METHYL-1,2-DIAZASPIRO[4.5]DEC-1-EN-3-YL ACETATE
| Molecular Formula | C11H18N2O2 |
|---|---|
| Molecular Weight | 210.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.13683 |
| Heavy Atoms | 15 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 34281-13-5 |
|---|---|
| SMILES | CC(=O)OC1(CC2(CCCCC2)N=N1)C |
| InChIKey | VEKLEFHAXXKBPL-UHFFFAOYSA-N |
Product Overview
(3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate (CAS 34281-13-5), with molecular formula C11H18N2O2 and molecular weight 210.14 g/mol. IUPAC: (3-methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate.
Chemical Property Profile of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate
Property Insights of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate. With a topological polar surface area (TPSA) of 51.0 Ų, (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate 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-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate?
The CAS number of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate is 34281-13-5.
What is the molecular formula of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate?
The molecular formula of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate is C11H18N2O2.
What is the molecular weight of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate?
The molecular weight of (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate is 210.14 g/mol.
Where can I buy (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate?
You can request a quote for (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (3-Methyl-1,2-diazaspiro[4.5]dec-1-en-3-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.