| CAS Number | 1319255-36-1 |
| Catalog Number | AG000ZXA(AGN-PC-0WAM8J) |
| Chemical Name | Thiazole, 5-bromo-2-(difluoromethyl)- |
| IUPAC Name | 5-bromo-2-(difluoromethyl)-1,3-thiazole |
| InChI | InChI=1S/C4H2BrF2NS/c5-2-1-8-4(9-2)3(6)7/h1,3H |
| InChI Key | RTILAKBVRIHMNT-UHFFFAOYSA-N |
| MDL Number | MFCD23106373 |
| Molecular Formula | C4H2BrF2NS |
| Molecular Weight | 214.0312 |
| SMILES | FC(C1=NC=C(Br)S1)F |
| Synonyms | 5-bromo-2-(difluoromethyl)thiazole,
1319255-36-1,
5-bromo-2-(difluoromethyl)-1,3-thiazole,
SCHEMBL19552058,
MFCD23106373,
ZINC95743228,
AKOS024217277,
Thiazole,5-bromo-2-(difluoromethyl)-,
DS-7596,
PB37411,
SB10728,
KS-0000041L,
Thiazole, 5-bromo-2-(difluoromethyl)-,
AK170786,
CS-0050637,
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| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.906g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.028g/mol |
| Monoisotopic Mass | 212.906g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H227-H315-H319-H335
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Packing Group
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Precautionary statements
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P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number