4-溴噻吩-2-甲醛
TL;DR: 4-溴噻吩-2-甲醛 (CAS 18791-75-8) is a chemical compound with molecular formula C5H3BrOS and molecular weight 189.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-溴噻吩-2-甲醛
4-bromothiophene-2-carbaldehyde
Also Known As: 4-Bromo-2-thiophenecarboxaldehyde, 4-Bromothiophene-2-carbaldehyde, 4-Bromothiophene-2-carboxaldehyde, 4-Bromo-2-formylthiophene, 2-Thiophenecarboxaldehyde, 4-bromo-
| Molecular Formula | C5H3BrOS |
|---|---|
| Molecular Weight | 189.91 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.9088 |
| Heavy Atoms | 8 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 18791-75-8 |
|---|---|
| SMILES | C1=C(SC=C1Br)C=O |
| InChIKey | PDONIKHDXYHTLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-溴噻吩-2-甲醛 (CAS 18791-75-8), with molecular formula C5H3BrOS and molecular weight 189.91 g/mol. IUPAC: 4-bromothiophene-2-carbaldehyde.
Chemical Property Profile of 4-溴噻吩-2-甲醛
Property Insights of 4-溴噻吩-2-甲醛
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-溴噻吩-2-甲醛. With a topological polar surface area (TPSA) of 45.3 Ų, 4-溴噻吩-2-甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-溴噻吩-2-甲醛 has 0 hydrogen bond donor(s) and 2 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-溴噻吩-2-甲醛?
The CAS number of 4-溴噻吩-2-甲醛 is 18791-75-8.
What is the molecular formula of 4-溴噻吩-2-甲醛?
The molecular formula of 4-溴噻吩-2-甲醛 is C5H3BrOS.
What is the molecular weight of 4-溴噻吩-2-甲醛?
The molecular weight of 4-溴噻吩-2-甲醛 is 189.91 g/mol.
Where can I buy 4-溴噻吩-2-甲醛?
You can request a quote for 4-溴噻吩-2-甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-溴噻吩-2-甲醛?
Yes, KEHONG BIO provides custom synthesis services for 4-溴噻吩-2-甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.