| CAS Number | 131748-97-5 |
| Catalog Number | AG000ZOO(AGN-PC-00427G) |
| Chemical Name | 5-Thiazolemethanol, 2-(trifluoromethyl)- |
| IUPAC Name | [2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol |
| InChI | InChI=1S/C5H4F3NOS/c6-5(7,8)4-9-1-3(2-10)11-4/h1,10H,2H2 |
| InChI Key | CJKBHQFTYWBAQP-UHFFFAOYSA-N |
| MDL Number | MFCD18632535 |
| Molecular Formula | C5H4F3NOS |
| Molecular Weight | 183.1516 |
| SMILES | OCC1=CN=C(C(F)(F)F)S1 |
| Synonyms | (2-(trifluoromethyl)thiazol-5-yl)methanol,
131748-97-5,
[2-(Trifluoromethyl)-1,3-thiazol-5-yl]methanol,
5-Thiazolemethanol, 2-(trifluoromethyl)-,
SCHEMBL5751006,
DTXSID50569511,
CJKBHQFTYWBAQP-UHFFFAOYSA-N,
MFCD18632535,
ZINC34492482,
AKOS006371272,
NE57491,
QC-3007,
KS-00000Q40,
AK321925,
DS-11963,
AB0066615,
5-(Hydroxymethyl)-2-(trifluoromethyl)-1,3-thiazole,
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| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.148g/mol |
| Monoisotopic Mass | 182.997g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number