TL;DR: (4-Bromo-2-thienyl)methanol (CAS 102191-92-4) is a chemical compound with molecular formula C5H5BrOS and molecular weight 191.92445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-bromothiophen-2-yl)methanol
Also Known As: (4-bromothiophen-2-yl)methanol, (4-BROMO-2-THIENYL)METHANOL, 4-BROMO-2-(HYDROXYMETHYL)THIOPHENE, 4-BROMO-2-THIOPHENEMETHANOL, 2-Thiophenemethanol, 4-bromo-
| Molecular Formula | C5H5BrOS |
| Molecular Weight | 191.92445 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.92445 Da |
| Heavy Atoms | 8 |
| Complexity | 78.0 |
| SMILES | C1=C(SC=C1Br)CO |
| InChIKey | PXZNJHHUYJRFPZ-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Bromo-2-thienyl)methanol. With a topological polar surface area (TPSA) of 48.5 Ų, (4-Bromo-2-thienyl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromo-2-thienyl)methanol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-Bromo-2-thienyl)methanol is 102191-92-4.
The molecular formula of (4-Bromo-2-thienyl)methanol is C5H5BrOS.
The molecular weight of (4-Bromo-2-thienyl)methanol is 191.92445 g/mol.
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