2-甲基-3-氧代丙酸
TL;DR: 2-甲基-3-氧代丙酸 (CAS 6236-08-4) is a chemical compound with molecular formula C4H6O3 and molecular weight 102.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲基-3-氧代丙酸
2-methyl-3-oxopropanoic acid
Also Known As: 2-methyl-3-oxopropanoic acid, Methylmalonaldehydic acid, Methylmalonate semialdehyde, 2-methyl-3-oxopropanoate, 3-Oxo-2-methylpropanoate
| Molecular Formula | C4H6O3 |
|---|---|
| Molecular Weight | 102.03 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.03169 |
| Heavy Atoms | 7 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 6236-08-4 |
|---|---|
| SMILES | CC(C=O)C(=O)O |
| InChIKey | VOKUMXABRRXHAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-甲基-3-氧代丙酸 (CAS 6236-08-4), with molecular formula C4H6O3 and molecular weight 102.03 g/mol. IUPAC: 2-methyl-3-oxopropanoic acid.
Chemical Property Profile of 2-甲基-3-氧代丙酸
Property Insights of 2-甲基-3-氧代丙酸
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-甲基-3-氧代丙酸. With a topological polar surface area (TPSA) of 54.4 Ų, 2-甲基-3-氧代丙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲基-3-氧代丙酸 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 2-甲基-3-氧代丙酸?
The CAS number of 2-甲基-3-氧代丙酸 is 6236-08-4.
What is the molecular formula of 2-甲基-3-氧代丙酸?
The molecular formula of 2-甲基-3-氧代丙酸 is C4H6O3.
What is the molecular weight of 2-甲基-3-氧代丙酸?
The molecular weight of 2-甲基-3-氧代丙酸 is 102.03 g/mol.
Where can I buy 2-甲基-3-氧代丙酸?
You can request a quote for 2-甲基-3-氧代丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基-3-氧代丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基-3-氧代丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.