3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-
TL;DR: 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- (CAS 6699-11-2) is a chemical compound with molecular formula C21H29NO and molecular weight 311.2249 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(dimethylamino)-4-ethyl-4-naphthalen-1-ylheptan-3-one
Also Known As: 7- -4-ethyl-4- -3-heptanone, 7-(Dimethylamino)-4-ethyl-4-(1-naphthyl)-3-heptanone, 3-HEPTANONE, 7-(DIMETHYLAMINO)-4-ETHYL-4-(1-NAPHTHYL)-, 7-(dimethylamino)-4-ethyl-4-(naphthalen-1-yl)heptan-3-one, 7-(Dimethylamino)-4-ethyl-4-(1-naphthalenyl)-3-heptanone
Technical Specifications
| Molecular Formula | C21H29NO |
| Molecular Weight | 311.2249 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 311.2249 Da |
| Heavy Atoms | 23 |
| Complexity | 378.0 |
| SMILES | CCC(=O)C(CC)(CCCN(C)C)C1=CC=CC2=CC=CC=C21 |
| InChIKey | VNEWLBTYRSJDAS-UHFFFAOYSA-N |
Chemical Property Profile of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-
Property Insights of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-
The XLogP value of 4.8 indicates that 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-?
The CAS number of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- is 6699-11-2.
What is the molecular formula of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-?
The molecular formula of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- is C21H29NO.
What is the molecular weight of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-?
The molecular weight of 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- is 311.2249 g/mol.
Where can I buy 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-?
You can request a quote for 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)-?
Yes, CoreyChem provides custom synthesis services for 3-Heptanone, 7-(dimethylamino)-4-ethyl-4-(1-naphthyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.