![8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester structure](/static/products/159/159329-32-5.webp)
8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester
TL;DR: 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester (CAS 159329-32-5) is a chemical compound with molecular formula C12H19BrO4 and molecular weight 306.04666 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 8-(bromomethyl)-1,4-dioxaspiro[4.5]decane-8-carboxylate
Also Known As: ethyl 8-(bromomethyl)-1,4-dioxaspiro[4.5]decane-8-carboxylate, ethyl 1-bromomethyl-4,4-ethylenedioxycyclohexanecarboxylate, 8-bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester
Technical Specifications
| Molecular Formula | C12H19BrO4 |
| Molecular Weight | 306.04666 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.04666 Da |
| Heavy Atoms | 17 |
| Complexity | 276.0 |
| SMILES | CCOC(=O)C1(CCC2(CC1)OCCO2)CBr |
| InChIKey | NIOZIGDAXFKNBK-UHFFFAOYSA-N |
Chemical Property Profile of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester
Property Insights of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 44.8 Ų, 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester 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
What is the CAS number of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester?
The CAS number of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester is 159329-32-5.
What is the molecular formula of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester?
The molecular formula of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester is C12H19BrO4.
What is the molecular weight of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester?
The molecular weight of 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester is 306.04666 g/mol.
Where can I buy 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester?
You can request a quote for 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester?
Yes, CoreyChem provides custom synthesis services for 8-Bromomethyl-1,4-dioxa-spiro[4.5]decane-8-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.