3-(2-甲氧基苯基)-2-巯基丙烯酸
TL;DR: 3-(2-甲氧基苯基)-2-巯基丙烯酸 (CAS 42056-18-8) is a chemical compound with molecular formula C10H10O3S and molecular weight 210.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-甲氧基苯基)-2-巯基丙烯酸
3-(2-methoxyphenyl)-2-sulfanylprop-2-enoic acid
Also Known As: ALPHA-MERCAPTO-2-METHOXYCINNAMIC ACID, 3-(2-methoxyphenyl)-2-sulfanylprop-2-enoic acid
| Molecular Formula | C10H10O3S |
|---|---|
| Molecular Weight | 210.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 47.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.03506 |
| Heavy Atoms | 14 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 42056-18-8 |
|---|---|
| SMILES | COC1=CC=CC=C1C=C(C(=O)O)S |
| InChIKey | CYTWHBLSXGROPM-UHFFFAOYSA-N |
Product Overview
3-(2-甲氧基苯基)-2-巯基丙烯酸 (CAS 42056-18-8), with molecular formula C10H10O3S and molecular weight 210.04 g/mol. IUPAC: 3-(2-methoxyphenyl)-2-sulfanylprop-2-enoic acid.
Chemical Property Profile of 3-(2-甲氧基苯基)-2-巯基丙烯酸
Property Insights of 3-(2-甲氧基苯基)-2-巯基丙烯酸
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-甲氧基苯基)-2-巯基丙烯酸. With a topological polar surface area (TPSA) of 47.5 Ų, 3-(2-甲氧基苯基)-2-巯基丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-甲氧基苯基)-2-巯基丙烯酸 has 2 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 3-(2-甲氧基苯基)-2-巯基丙烯酸?
The CAS number of 3-(2-甲氧基苯基)-2-巯基丙烯酸 is 42056-18-8.
What is the molecular formula of 3-(2-甲氧基苯基)-2-巯基丙烯酸?
The molecular formula of 3-(2-甲氧基苯基)-2-巯基丙烯酸 is C10H10O3S.
What is the molecular weight of 3-(2-甲氧基苯基)-2-巯基丙烯酸?
The molecular weight of 3-(2-甲氧基苯基)-2-巯基丙烯酸 is 210.04 g/mol.
Where can I buy 3-(2-甲氧基苯基)-2-巯基丙烯酸?
You can request a quote for 3-(2-甲氧基苯基)-2-巯基丙烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-甲氧基苯基)-2-巯基丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-甲氧基苯基)-2-巯基丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.