| CAS Number | 1378729-97-5 |
| Catalog Number | AG01ACQV(AGN-PC-0WO1XJ) |
| Chemical Name | 1H-Imidazol-2-yl(thiophen-2-yl)methanol |
| IUPAC Name | 1H-imidazol-2-yl(thiophen-2-yl)methanol |
| InChI | InChI=1S/C8H8N2OS/c11-7(6-2-1-5-12-6)8-9-3-4-10-8/h1-5,7,11H,(H,9,10) |
| InChI Key | ZQSWKNKGXXCQEA-UHFFFAOYSA-N |
| MDL Number | MFCD20686329 |
| Molecular Formula | C8H8N2OS |
| Molecular Weight | 180.2269 |
| SMILES | OC(C1NC=CN=1)C1SC=CC=1 |
| Synonyms | 1H-imidazol-2-yl(thiophen-2-yl)methanol,
1378729-97-5,
AKOS017532085,
NE16674,
(1H-Imidazol-2-yl)(thiophen-2-yl)methanol,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.225g/mol |
| Monoisotopic Mass | 180.036g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 77.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Certificate of Analysis
Lot Number