4-氧代-4-(噻吩-3-基)丁酸
TL;DR: 4-氧代-4-(噻吩-3-基)丁酸 (CAS 1878-23-5) is a chemical compound with molecular formula C8H8O3S and molecular weight 184.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氧代-4-(噻吩-3-基)丁酸
4-oxo-4-thiophen-3-ylbutanoic acid
Also Known As: 4-oxo-4-(thiophen-3-yl)butanoic acid, 4-oxo-4-thiophen-3-ylbutanoic acid, 3-(3-thenoyl)propionic acid, 4-Oxo-4-(3-thienyl)butanoic acid, 4-oxo-4-(thiophen-3-yl)butanoicacid
| Molecular Formula | C8H8O3S |
|---|---|
| Molecular Weight | 184.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.01941 |
| Heavy Atoms | 12 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 1878-23-5 |
|---|---|
| SMILES | C1=CSC=C1C(=O)CCC(=O)O |
| InChIKey | YBGPMJKHIYTKIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氧代-4-(噻吩-3-基)丁酸 (CAS 1878-23-5), with molecular formula C8H8O3S and molecular weight 184.02 g/mol. IUPAC: 4-oxo-4-thiophen-3-ylbutanoic acid.
Chemical Property Profile of 4-氧代-4-(噻吩-3-基)丁酸
Property Insights of 4-氧代-4-(噻吩-3-基)丁酸
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氧代-4-(噻吩-3-基)丁酸. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氧代-4-(噻吩-3-基)丁酸. Following Lipinski's Rule of Five, 4-氧代-4-(噻吩-3-基)丁酸 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 4-氧代-4-(噻吩-3-基)丁酸?
The CAS number of 4-氧代-4-(噻吩-3-基)丁酸 is 1878-23-5.
What is the molecular formula of 4-氧代-4-(噻吩-3-基)丁酸?
The molecular formula of 4-氧代-4-(噻吩-3-基)丁酸 is C8H8O3S.
What is the molecular weight of 4-氧代-4-(噻吩-3-基)丁酸?
The molecular weight of 4-氧代-4-(噻吩-3-基)丁酸 is 184.02 g/mol.
Where can I buy 4-氧代-4-(噻吩-3-基)丁酸?
You can request a quote for 4-氧代-4-(噻吩-3-基)丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氧代-4-(噻吩-3-基)丁酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氧代-4-(噻吩-3-基)丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.