Methyl 2-chloro-3-hydroxybutanoate
TL;DR: Methyl 2-chloro-3-hydroxybutanoate (CAS 1534350-84-9) is a chemical compound with molecular formula C5H9ClO3 and molecular weight 152.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-chloro-3-hydroxybutanoate
Also Known As: Methyl 2-chloro-3-hydroxybutanoate, methyl2-chloro-3-hydroxybutanoate, Methyl 2-chloro-3-hydroxybutanoate #, Butyric acid, 2-chloro-3-hydroxy-, methyl ester, erythro-
Technical Specifications
| Molecular Formula | C5H9ClO3 |
| Molecular Weight | 152.02402 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.02402 Da |
| Heavy Atoms | 9 |
| Complexity | 104.0 |
| SMILES | CC(C(C(=O)OC)Cl)O |
| InChIKey | ZDCDXBCIJDUWEO-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-chloro-3-hydroxybutanoate
Property Insights of Methyl 2-chloro-3-hydroxybutanoate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-chloro-3-hydroxybutanoate. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl 2-chloro-3-hydroxybutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-chloro-3-hydroxybutanoate 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
What is the CAS number of Methyl 2-chloro-3-hydroxybutanoate?
The CAS number of Methyl 2-chloro-3-hydroxybutanoate is 1534350-84-9.
What is the molecular formula of Methyl 2-chloro-3-hydroxybutanoate?
The molecular formula of Methyl 2-chloro-3-hydroxybutanoate is C5H9ClO3.
What is the molecular weight of Methyl 2-chloro-3-hydroxybutanoate?
The molecular weight of Methyl 2-chloro-3-hydroxybutanoate is 152.02402 g/mol.
Where can I buy Methyl 2-chloro-3-hydroxybutanoate?
You can request a quote for Methyl 2-chloro-3-hydroxybutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-chloro-3-hydroxybutanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-chloro-3-hydroxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.