5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸
TL;DR: 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 (CAS 38088-86-7) is a chemical compound with molecular formula C10H18O4 and molecular weight 202.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸
5,5-diethyl-2-methyl-1,3-dioxane-2-carboxylic acid
Also Known As: 5,5-diethyl-2-methyl-1,3-dioxane-2-carboxylic acid
| Molecular Formula | C10H18O4 |
|---|---|
| Molecular Weight | 202.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.12051 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 38088-86-7 |
|---|---|
| SMILES | CCC1(COC(OC1)(C)C(=O)O)CC |
| InChIKey | KUXCAIQJTVVMSE-UHFFFAOYSA-N |
Product Overview
5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 (CAS 38088-86-7), with molecular formula C10H18O4 and molecular weight 202.12 g/mol. IUPAC: 5,5-diethyl-2-methyl-1,3-dioxane-2-carboxylic acid.
Chemical Property Profile of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸
Property Insights of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸. With a topological polar surface area (TPSA) of 55.8 Ų, 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 has 1 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 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸?
The CAS number of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 is 38088-86-7.
What is the molecular formula of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸?
The molecular formula of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 is C10H18O4.
What is the molecular weight of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸?
The molecular weight of 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 is 202.12 g/mol.
Where can I buy 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸?
You can request a quote for 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5,5-二乙基-2-甲基-1,3-二噁烷-2-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.