3,3-二甲基戊二酸酐
TL;DR: 3,3-二甲基戊二酸酐 (CAS 4160-82-1) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-二甲基戊二酸酐
4,4-dimethyloxane-2,6-dione
Also Known As: 3,3-Dimethylglutaric anhydride, 4,4-dimethyloxane-2,6-dione, 4,4-Dimethyldihydro-2H-pyran-2,6(3H)-dione, 2H-Pyran-2,6(3H)-dione, dihydro-4,4-dimethyl-, Glutaric anhydride, 3,3-dimethyl-
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 4160-82-1 |
|---|---|
| SMILES | CC1(CC(=O)OC(=O)C1)C |
| InChIKey | HIJQFTSZBHDYKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3-二甲基戊二酸酐 (CAS 4160-82-1), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: 4,4-dimethyloxane-2,6-dione.
Chemical Property Profile of 3,3-二甲基戊二酸酐
Property Insights of 3,3-二甲基戊二酸酐
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-二甲基戊二酸酐. With a topological polar surface area (TPSA) of 43.4 Ų, 3,3-二甲基戊二酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-二甲基戊二酸酐 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 3,3-二甲基戊二酸酐?
The CAS number of 3,3-二甲基戊二酸酐 is 4160-82-1.
What is the molecular formula of 3,3-二甲基戊二酸酐?
The molecular formula of 3,3-二甲基戊二酸酐 is C7H10O3.
What is the molecular weight of 3,3-二甲基戊二酸酐?
The molecular weight of 3,3-二甲基戊二酸酐 is 142.06 g/mol.
Where can I buy 3,3-二甲基戊二酸酐?
You can request a quote for 3,3-二甲基戊二酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-二甲基戊二酸酐?
Yes, KEHONG BIO provides custom synthesis services for 3,3-二甲基戊二酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.