2-(Thiophen-2-ylmethyl)butanedioic acid
TL;DR: 2-(Thiophen-2-ylmethyl)butanedioic acid (CAS 90536-68-8) is a chemical compound with molecular formula C9H10O4S and molecular weight 214.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(thiophen-2-ylmethyl)butanedioic acid
Also Known As: 2-(2-thienylmethyl)succinic acid, 2-(thiophen-2-ylmethyl)butanedioic acid, Butanedioic acid, 2-(2-thienylmethyl), AI-942/13331196
| Molecular Formula | C9H10O4S |
|---|---|
| Molecular Weight | 214.03 g/mol |
| LogP | 1.4661 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.02998 |
| Heavy Atoms | 14 |
| Complexity | 317.56277 |
Chemical Identifiers
| CAS Number | 90536-68-8 |
|---|---|
| SMILES | C1=CSC(=C1)CC(CC(=O)O)C(=O)O |
Product Overview
2-(Thiophen-2-ylmethyl)butanedioic acid (CAS 90536-68-8), with molecular formula C9H10O4S and molecular weight 214.03 g/mol. IUPAC: 2-(thiophen-2-ylmethyl)butanedioic acid.
Chemical Property Profile of 2-(Thiophen-2-ylmethyl)butanedioic acid
Property Insights of 2-(Thiophen-2-ylmethyl)butanedioic acid
The XLogP value of 1.4661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Thiophen-2-ylmethyl)butanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Thiophen-2-ylmethyl)butanedioic acid. Following Lipinski's Rule of Five, 2-(Thiophen-2-ylmethyl)butanedioic acid has 2 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 2-(Thiophen-2-ylmethyl)butanedioic acid?
The CAS number of 2-(Thiophen-2-ylmethyl)butanedioic acid is 90536-68-8.
What is the molecular formula of 2-(Thiophen-2-ylmethyl)butanedioic acid?
The molecular formula of 2-(Thiophen-2-ylmethyl)butanedioic acid is C9H10O4S.
What is the molecular weight of 2-(Thiophen-2-ylmethyl)butanedioic acid?
The molecular weight of 2-(Thiophen-2-ylmethyl)butanedioic acid is 214.03 g/mol.
Where can I buy 2-(Thiophen-2-ylmethyl)butanedioic acid?
You can request a quote for 2-(Thiophen-2-ylmethyl)butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Thiophen-2-ylmethyl)butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Thiophen-2-ylmethyl)butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.