叔戊酸酐
TL;DR: 叔戊酸酐 (CAS 1538-75-6) is a chemical compound with molecular formula C10H18O3 and molecular weight 186.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
叔戊酸酐
2,2-dimethylpropanoyl 2,2-dimethylpropanoate
Also Known As: Trimethylacetic anhydride, Pivalic anhydride, Pivalicanhydride, Pivalic anydride, Dipivalic anhydride
| Molecular Formula | C10H18O3 |
|---|---|
| Molecular Weight | 186.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.1256 |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
| Boiling Point | 193 °C @760 [mm Hg] |
| Density | 0.918 @25 °C |
Chemical Identifiers
| CAS Number | 1538-75-6 |
|---|---|
| SMILES | CC(C)(C)C(=O)OC(=O)C(C)(C)C |
| InChIKey | PGZVFRAEAAXREB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
叔戊酸酐 (CAS 1538-75-6), with molecular formula C10H18O3 and molecular weight 186.13 g/mol. IUPAC: 2,2-dimethylpropanoyl 2,2-dimethylpropanoate.
Chemical Property Profile of 叔戊酸酐
Property Insights of 叔戊酸酐
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 叔戊酸酐. With a topological polar surface area (TPSA) of 43.4 Ų, 叔戊酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 叔戊酸酐 has 0 hydrogen bond donor(s) and 3 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 叔戊酸酐?
The CAS number of 叔戊酸酐 is 1538-75-6.
What is the molecular formula of 叔戊酸酐?
The molecular formula of 叔戊酸酐 is C10H18O3.
What is the molecular weight of 叔戊酸酐?
The molecular weight of 叔戊酸酐 is 186.13 g/mol.
Where can I buy 叔戊酸酐?
You can request a quote for 叔戊酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 叔戊酸酐?
Yes, KEHONG BIO provides custom synthesis services for 叔戊酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.