2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-
TL;DR: 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- (CAS 802837-91-8) 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-ethyl-3-methyl-3-thiophen-2-yloxirane-2-carboxylic acid
Also Known As: 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-, 2-ethyl-3-methyl-3-thiophen-2-yloxirane-2-carboxylic acid, 2-Thiopheneglycidic acid, alpha-ethyl-b?ta-methyl- (8CI), 2-ETHYL-3-METHYL-3-(THIOPHEN-2-YL)OXIRANE-2-CARBOXYLIC ACID
| Molecular Formula | C10H12O3S |
|---|---|
| Molecular Weight | 212.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.05072 |
| Heavy Atoms | 14 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 802837-91-8 |
|---|---|
| SMILES | CCC1(C(O1)(C)C2=CC=CS2)C(=O)O |
| InChIKey | ORVSBSUQWSVTII-UHFFFAOYSA-N |
Product Overview
2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- (CAS 802837-91-8), with molecular formula C10H12O3S and molecular weight 212.05 g/mol. IUPAC: 2-ethyl-3-methyl-3-thiophen-2-yloxirane-2-carboxylic acid.
Chemical Property Profile of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-
Property Insights of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-. Following Lipinski's Rule of Five, 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- 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-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-?
The CAS number of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- is 802837-91-8.
What is the molecular formula of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-?
The molecular formula of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- is C10H12O3S.
What is the molecular weight of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-?
The molecular weight of 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- is 212.05 g/mol.
Where can I buy 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-?
You can request a quote for 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxiranecarboxylicacid, 2-ethyl-3-methyl-3-(2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.