![2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione structure](/static/products/112/112630-08-7.webp)
2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione
TL;DR: 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione (CAS 112630-08-7) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-3-(dimethylamino)prop-2-enylidene]cyclohexane-1,3-dione
Also Known As: IDI1_024591, 2-[3-(dimethylamino)-2-propenylidene]-1,3-cyclohexanedione, 2-[(E)-3-(dimethylamino)prop-2-enylidene]cyclohexane-1,3-dione, 2-[(2E)-3-(dimethylamino)prop-2-en-1-ylidene]cyclohexane-1,3-dione, BRD-K24344555-001-01-6
Technical Specifications
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 282.0 |
| SMILES | CN(C)/C=C/C=C1C(=O)CCCC1=O |
| InChIKey | NTATWNGYBCNGDV-XBXARRHUSA-N |
Chemical Property Profile of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione
Property Insights of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione. With a topological polar surface area (TPSA) of 37.4 Ų, 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione?
The CAS number of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione is 112630-08-7.
What is the molecular formula of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione?
The molecular formula of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione is C11H15NO2.
What is the molecular weight of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione?
The molecular weight of 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione is 193.11028 g/mol.
Where can I buy 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione?
You can request a quote for 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione?
Yes, CoreyChem provides custom synthesis services for 2-[3-(Dimethylamino)-2-propenylidene]-1,3-cyclohexanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.