![2-[(3-甲氧基苯基)甲硫基]乙酸 structure](/static/products/1892/18926-47-1.webp)
2-[(3-甲氧基苯基)甲硫基]乙酸
TL;DR: 2-[(3-甲氧基苯基)甲硫基]乙酸 (CAS 18926-47-1) is a chemical compound with molecular formula C10H12O3S and molecular weight 212.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-甲氧基苯基)甲硫基]乙酸
2-[(3-methoxyphenyl)methylsulfanyl]acetic acid
Also Known As: NCIStruc1_000755, NCIStruc2_000698, [(3-methoxybenzyl)thio]acetic acid, 2-[(3-methoxyphenyl)methylsulfanyl]acetic acid, 3-methoxybenzylmercaptoacetic acid
| Molecular Formula | C10H12O3S |
|---|---|
| Molecular Weight | 212.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.05072 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 18926-47-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSCC(=O)O |
| InChIKey | QMFCNAYBAHKUKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(3-甲氧基苯基)甲硫基]乙酸 (CAS 18926-47-1), with molecular formula C10H12O3S and molecular weight 212.05 g/mol. IUPAC: 2-[(3-methoxyphenyl)methylsulfanyl]acetic acid.
Chemical Property Profile of 2-[(3-甲氧基苯基)甲硫基]乙酸
Property Insights of 2-[(3-甲氧基苯基)甲硫基]乙酸
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-甲氧基苯基)甲硫基]乙酸. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-甲氧基苯基)甲硫基]乙酸. Following Lipinski's Rule of Five, 2-[(3-甲氧基苯基)甲硫基]乙酸 has 1 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-[(3-甲氧基苯基)甲硫基]乙酸?
The CAS number of 2-[(3-甲氧基苯基)甲硫基]乙酸 is 18926-47-1.
What is the molecular formula of 2-[(3-甲氧基苯基)甲硫基]乙酸?
The molecular formula of 2-[(3-甲氧基苯基)甲硫基]乙酸 is C10H12O3S.
What is the molecular weight of 2-[(3-甲氧基苯基)甲硫基]乙酸?
The molecular weight of 2-[(3-甲氧基苯基)甲硫基]乙酸 is 212.05 g/mol.
Where can I buy 2-[(3-甲氧基苯基)甲硫基]乙酸?
You can request a quote for 2-[(3-甲氧基苯基)甲硫基]乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-甲氧基苯基)甲硫基]乙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-甲氧基苯基)甲硫基]乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.