2-羟基-2-甲基乙酰丙酸
TL;DR: 2-羟基-2-甲基乙酰丙酸 (CAS 85963-69-5) is a chemical compound with molecular formula CC(=O)CC(C)(C(=O)O)O and molecular weight 146.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-羟基-2-甲基乙酰丙酸
2-hydroxy-2-methyl-4-oxopentanoic acid
Also Known As: 2-Hmla, 2-Hydroxy-2-methyllevulinic acid, 2-hydroxy-2-methyllevulinicacid, 2-hydroxy-2-methyl-4-oxopentanoic acid, 2-Hydroxy-4-oxo-2-methyl-pentansaeure
| Molecular Formula | CC(=O)CC(C)(C(=O)O)O |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 85963-69-5 |
|---|---|
| SMILES | CC(=O)CC(C)(C(=O)O)O |
| InChIKey | WCUFLIBXUCELCS-UHFFFAOYSA-N |
Product Overview
2-羟基-2-甲基乙酰丙酸 (CAS 85963-69-5), with molecular formula CC(=O)CC(C)(C(=O)O)O and molecular weight 146.06 g/mol. IUPAC: 2-hydroxy-2-methyl-4-oxopentanoic acid.
Chemical Property Profile of 2-羟基-2-甲基乙酰丙酸
Property Insights of 2-羟基-2-甲基乙酰丙酸
The XLogP value of -1.0 indicates that 2-羟基-2-甲基乙酰丙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-羟基-2-甲基乙酰丙酸. Following Lipinski's Rule of Five, 2-羟基-2-甲基乙酰丙酸 has 2 hydrogen bond donor(s) and 4 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 2-羟基-2-甲基乙酰丙酸?
The CAS number of 2-羟基-2-甲基乙酰丙酸 is 85963-69-5.
What is the molecular formula of 2-羟基-2-甲基乙酰丙酸?
The molecular formula of 2-羟基-2-甲基乙酰丙酸 is CC(=O)CC(C)(C(=O)O)O.
What is the molecular weight of 2-羟基-2-甲基乙酰丙酸?
The molecular weight of 2-羟基-2-甲基乙酰丙酸 is 146.06 g/mol.
Where can I buy 2-羟基-2-甲基乙酰丙酸?
You can request a quote for 2-羟基-2-甲基乙酰丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-羟基-2-甲基乙酰丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-羟基-2-甲基乙酰丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.