Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone
TL;DR: Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone (CAS 7227-96-5) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-4-propan-2-yloxetan-2-one
Also Known As: 3,3-dimethyl-4-propan-2-yloxetan-2-one, 3,3-dimethyl-4-(1-methylethyl)-2-Oxetanone, Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 7227-96-5 |
|---|---|
| SMILES | CC(C)C1C(C(=O)O1)(C)C |
| InChIKey | JMHWSGPTHJGHMB-UHFFFAOYSA-N |
Product Overview
Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone (CAS 7227-96-5), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: 3,3-dimethyl-4-propan-2-yloxetan-2-one.
Chemical Property Profile of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone
Property Insights of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone. With a topological polar surface area (TPSA) of 26.3 Ų, Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone 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 Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone?
The CAS number of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone is 7227-96-5.
What is the molecular formula of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone?
The molecular formula of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone is C8H14O2.
What is the molecular weight of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone?
The molecular weight of Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone is 142.10 g/mol.
Where can I buy Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone?
You can request a quote for Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.