Dimethyl deca-4,6-diynedioate
TL;DR: Dimethyl deca-4,6-diynedioate (CAS 24806-93-7) is a chemical compound with molecular formula C12H14O4 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl deca-4,6-diynedioate
Also Known As: dimethyl deca-4,6-diynedioate, dimethyl 4,6-decadiyne-1,10-dioate, 4,6-Decadiynedioic acid, dimethyl ester, deca-4:6-diynedioic acid dimethyl ester, 4,6-Decadiynedioicacid, 1,10-dimethyl ester
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 24806-93-7 |
|---|---|
| SMILES | COC(=O)CCC#CC#CCCC(=O)OC |
| InChIKey | LJJQOVUCWFWDOT-UHFFFAOYSA-N |
Product Overview
Dimethyl deca-4,6-diynedioate (CAS 24806-93-7), with molecular formula C12H14O4 and molecular weight 222.09 g/mol. IUPAC: dimethyl deca-4,6-diynedioate.
Chemical Property Profile of Dimethyl deca-4,6-diynedioate
Property Insights of Dimethyl deca-4,6-diynedioate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl deca-4,6-diynedioate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl deca-4,6-diynedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl deca-4,6-diynedioate 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 Dimethyl deca-4,6-diynedioate?
The CAS number of Dimethyl deca-4,6-diynedioate is 24806-93-7.
What is the molecular formula of Dimethyl deca-4,6-diynedioate?
The molecular formula of Dimethyl deca-4,6-diynedioate is C12H14O4.
What is the molecular weight of Dimethyl deca-4,6-diynedioate?
The molecular weight of Dimethyl deca-4,6-diynedioate is 222.09 g/mol.
Where can I buy Dimethyl deca-4,6-diynedioate?
You can request a quote for Dimethyl deca-4,6-diynedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl deca-4,6-diynedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl deca-4,6-diynedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.