| CAS Number | 1244948-92-2 |
| Catalog Number | AG000M3O(AGN-PC-0WD07Y) |
| Chemical Name | 4-Bromothiazole-5-carbaldehyde |
| IUPAC Name | 4-bromo-1,3-thiazole-5-carbaldehyde |
| InChI | InChI=1S/C4H2BrNOS/c5-4-3(1-7)8-2-6-4/h1-2H |
| InChI Key | FLPSVRVLOVLWCQ-UHFFFAOYSA-N |
| MDL Number | MFCD12025491 |
| Molecular Formula | C4H2BrNOS |
| Molecular Weight | 192.0338 |
| SMILES | O=CC1=C(Br)N=CS1 |
| Synonyms | 4-Bromothiazole-5-carbaldehyde,
1244948-92-2,
4-bromo-1,3-thiazole-5-carbaldehyde,
SCHEMBL13993965,
DTXSID70670355,
4-?Bromothiazole-?5-?carbaldehyde,
5-Thiazolecarboxaldehyde, 4-bromo-,
MFCD12025491,
ZINC38540800,
AKOS016845881,
FCH1169411,
AJ-96516,
AS-43033,
EN001208,
AX8218416,
Z-2546,
4-bromothiazole-5-carboxaldehyde,
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| Complexity | 100 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.904g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.03g/mol |
| Monoisotopic Mass | 190.904g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number