But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate
TL;DR: But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate (CAS 129320-13-4) is a chemical compound with molecular formula C17H29NO6 and molecular weight 343.1995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate
Also Known As: but-2-enedioic acid; 2-dimethylaminoethyl 2-cycloheptylacetate, 2-(Dimethylamino)ethyl cycloheptaneacetate (E)-2-butenedioate (1:1), Cycloheptaneacetic acid, 2-(dimethylamino)ethyl ester, (E)-2-butenedioate (1:1)
Technical Specifications
| Molecular Formula | C17H29NO6 |
| Molecular Weight | 343.1995 g/mol |
| XLogP | 2.1635 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.1995 Da |
| Heavy Atoms | 24 |
| Complexity | 315.0 |
| SMILES | CN(C)CCOC(=O)CC1CCCCCC1.C(=CC(=O)O)C(=O)O |
| InChIKey | ADRXUDOECUCYFV-UHFFFAOYSA-N |
Chemical Property Profile of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate
Property Insights of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate
The XLogP value of 2.1635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate. Following Lipinski's Rule of Five, But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate?
The CAS number of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate is 129320-13-4.
What is the molecular formula of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate?
The molecular formula of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate is C17H29NO6.
What is the molecular weight of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate?
The molecular weight of But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate is 343.1995 g/mol.
Where can I buy But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate?
You can request a quote for But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate?
Yes, CoreyChem provides custom synthesis services for But-2-enedioic acid;2-(dimethylamino)ethyl 2-cycloheptylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.