3-甲氧基-2-甲基丙烯酸
TL;DR: 3-甲氧基-2-甲基丙烯酸 (CAS 56674-63-6) is a chemical compound with molecular formula C5H8O3 and molecular weight 116.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲氧基-2-甲基丙烯酸
3-methoxy-2-methylprop-2-enoic acid
Also Known As: 3-methoxy-2-methylprop-2-enoic acid, (E)-3-methoxy-2-methylprop-2-enoic acid, (E)-3-methoxy-2-methyl-prop-2-enoic acid
| Molecular Formula | C5H8O3 |
|---|---|
| Molecular Weight | 116.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 116.04734 |
| Heavy Atoms | 8 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 56674-63-6 |
|---|---|
| SMILES | CC(=COC)C(=O)O |
| InChIKey | JQEBZBUGQPSANC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲氧基-2-甲基丙烯酸 (CAS 56674-63-6), with molecular formula C5H8O3 and molecular weight 116.05 g/mol. IUPAC: 3-methoxy-2-methylprop-2-enoic acid.
Chemical Property Profile of 3-甲氧基-2-甲基丙烯酸
Property Insights of 3-甲氧基-2-甲基丙烯酸
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲氧基-2-甲基丙烯酸. With a topological polar surface area (TPSA) of 46.5 Ų, 3-甲氧基-2-甲基丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲氧基-2-甲基丙烯酸 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 3-甲氧基-2-甲基丙烯酸?
The CAS number of 3-甲氧基-2-甲基丙烯酸 is 56674-63-6.
What is the molecular formula of 3-甲氧基-2-甲基丙烯酸?
The molecular formula of 3-甲氧基-2-甲基丙烯酸 is C5H8O3.
What is the molecular weight of 3-甲氧基-2-甲基丙烯酸?
The molecular weight of 3-甲氧基-2-甲基丙烯酸 is 116.05 g/mol.
Where can I buy 3-甲氧基-2-甲基丙烯酸?
You can request a quote for 3-甲氧基-2-甲基丙烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲氧基-2-甲基丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-甲氧基-2-甲基丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.