1,2-Cyclopentanedione, 3,4,4-trimethyl-
TL;DR: 1,2-Cyclopentanedione, 3,4,4-trimethyl- (CAS 33079-56-0) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4-trimethylcyclopentane-1,2-dione
Also Known As: 3,4,4-Trimethylcyclopentane-1,2-dione, 1,2-Cyclopentanedione, 3,4,4-trimethyl-, 3,4,4-Trimethylcyclopentan-1,2-dion, 3,4,4-Trimethyl-1,2-cyclopentanedione, 3,4,4-Trimethyl-1,2-cylcopentanedione
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 33079-56-0 |
|---|---|
| SMILES | CC1C(=O)C(=O)CC1(C)C |
| InChIKey | YHJBEOWTWJHMFC-UHFFFAOYSA-N |
Product Overview
1,2-Cyclopentanedione, 3,4,4-trimethyl- (CAS 33079-56-0), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: 3,4,4-trimethylcyclopentane-1,2-dione.
Chemical Property Profile of 1,2-Cyclopentanedione, 3,4,4-trimethyl-
Property Insights of 1,2-Cyclopentanedione, 3,4,4-trimethyl-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Cyclopentanedione, 3,4,4-trimethyl-. With a topological polar surface area (TPSA) of 34.1 Ų, 1,2-Cyclopentanedione, 3,4,4-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclopentanedione, 3,4,4-trimethyl- has 0 hydrogen bond donor(s) and 2 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-Cyclopentanedione, 3,4,4-trimethyl-?
The CAS number of 1,2-Cyclopentanedione, 3,4,4-trimethyl- is 33079-56-0.
What is the molecular formula of 1,2-Cyclopentanedione, 3,4,4-trimethyl-?
The molecular formula of 1,2-Cyclopentanedione, 3,4,4-trimethyl- is C8H12O2.
What is the molecular weight of 1,2-Cyclopentanedione, 3,4,4-trimethyl-?
The molecular weight of 1,2-Cyclopentanedione, 3,4,4-trimethyl- is 140.08 g/mol.
Where can I buy 1,2-Cyclopentanedione, 3,4,4-trimethyl-?
You can request a quote for 1,2-Cyclopentanedione, 3,4,4-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclopentanedione, 3,4,4-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclopentanedione, 3,4,4-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.