| CAS Number | 91137-12-1 |
| Catalog Number | AG00GS4Y(AGN-PC-010KSX) |
| Chemical Name | 2-o-Tolyl-thiazole-4-carbaldehyde |
| IUPAC Name | 2-(2-methylphenyl)-1,3-thiazole-4-carbaldehyde |
| InChI | InChI=1S/C11H9NOS/c1-8-4-2-3-5-10(8)11-12-9(6-13)7-14-11/h2-7H,1H3 |
| InChI Key | DQAYNZAXEWVCBG-UHFFFAOYSA-N |
| MDL Number | MFCD06738366 |
| Molecular Formula | C11H9NOS |
| Molecular Weight | 203.2603 |
| SMILES | O=Cc1csc(n1)c1ccccc1C |
| Synonyms | 2-o-Tolyl-thiazole-4-carbaldehyde,
91137-12-1,
2-(o-Tolyl)thiazole-4-carbaldehyde,
2-(2-METHYLPHENYL)-1,3-THIAZOLE-4-CARBALDEHYDE,
CTK8F4501,
DTXSID10586188,
5097AH,
KM2979,
MFCD06738366,
ZINC19723114,
AKOS000320868,
AB26999,
AJ-74457,
DB-078914,
FT-0695553,
C11H9NOS,
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| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.259g/mol |
| Monoisotopic Mass | 203.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number