1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-
TL;DR: 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- (CAS 36903-65-8) is a chemical compound with molecular formula C10H16O3 and molecular weight 184.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-(3-methylbutyl)cyclopentane-1,3-dione
Also Known As: 3-Isopentyl-2-hydroxy-1,4-cyclopentanedione, 4-Hydroxy-5-isopentyl-1,3-cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)cyclopentane-1,3-dione, 4-Hydroxy-5-isopentyl-1,3-cyclopentanedione #, 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-
| Molecular Formula | C10H16O3 |
|---|---|
| Molecular Weight | 184.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.10994 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 36903-65-8 |
|---|---|
| SMILES | CC(C)CCC1C(C(=O)CC1=O)O |
| InChIKey | ROCGRTTYGQZGMI-UHFFFAOYSA-N |
Product Overview
1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- (CAS 36903-65-8), with molecular formula C10H16O3 and molecular weight 184.11 g/mol. IUPAC: 4-hydroxy-5-(3-methylbutyl)cyclopentane-1,3-dione.
Chemical Property Profile of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-
Property Insights of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-. With a topological polar surface area (TPSA) of 54.4 Ų, 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- has 1 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 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-?
The CAS number of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- is 36903-65-8.
What is the molecular formula of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-?
The molecular formula of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- is C10H16O3.
What is the molecular weight of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-?
The molecular weight of 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- is 184.11 g/mol.
Where can I buy 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-?
You can request a quote for 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclopentanedione, 4-hydroxy-5-(3-methylbutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.