1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-
TL;DR: 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- (CAS 6276-99-9) is a chemical compound with molecular formula C10H14Br2O4 and molecular weight 355.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1,2-dibromocyclobutane-1,2-dicarboxylate
Also Known As: KST-1B6415, diethyl 1,2-dibromocyclobutane-1,2-dicarboxylate, 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-
| Molecular Formula | C10H14Br2O4 |
|---|---|
| Molecular Weight | 355.93 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.92587 |
| Heavy Atoms | 16 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 6276-99-9 |
|---|---|
| SMILES | CCOC(=O)C1(CCC1(C(=O)OCC)Br)Br |
| InChIKey | XVDQRPZYIPSGDX-UHFFFAOYSA-N |
Product Overview
1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- (CAS 6276-99-9), with molecular formula C10H14Br2O4 and molecular weight 355.93 g/mol. IUPAC: diethyl 1,2-dibromocyclobutane-1,2-dicarboxylate.
Chemical Property Profile of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-
Property Insights of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-. With a topological polar surface area (TPSA) of 52.6 Ų, 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- 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 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-?
The CAS number of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- is 6276-99-9.
What is the molecular formula of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-?
The molecular formula of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- is C10H14Br2O4.
What is the molecular weight of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-?
The molecular weight of 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- is 355.93 g/mol.
Where can I buy 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-?
You can request a quote for 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclobutanedicarboxylic acid, 1,2-dibromo-, diethyl ester, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.