甲氧基苯乙酸
TL;DR: 甲氧基苯乙酸 (CAS 7021-09-2) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲氧基苯乙酸
2-methoxy-2-phenylacetic acid
Also Known As: 2-methoxy-2-phenylacetic acid, Methoxyphenylacetic acid, Methoxy(phenyl)acetic acid, MOPA, DL-alpha-METHOXYPHENYLACETIC ACID
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 7021-09-2 |
|---|---|
| SMILES | COC(C1=CC=CC=C1)C(=O)O |
| InChIKey | DIWVBIXQCNRCFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲氧基苯乙酸 (CAS 7021-09-2), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 2-methoxy-2-phenylacetic acid.
Chemical Property Profile of 甲氧基苯乙酸
Property Insights of 甲氧基苯乙酸
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲氧基苯乙酸. With a topological polar surface area (TPSA) of 46.5 Ų, 甲氧基苯乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲氧基苯乙酸 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 甲氧基苯乙酸?
The CAS number of 甲氧基苯乙酸 is 7021-09-2.
What is the molecular formula of 甲氧基苯乙酸?
The molecular formula of 甲氧基苯乙酸 is C9H10O3.
What is the molecular weight of 甲氧基苯乙酸?
The molecular weight of 甲氧基苯乙酸 is 166.06 g/mol.
Where can I buy 甲氧基苯乙酸?
You can request a quote for 甲氧基苯乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲氧基苯乙酸?
Yes, KEHONG BIO provides custom synthesis services for 甲氧基苯乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.