| CAS Number | 305811-37-4 |
| Catalog Number | AG0030LJ(AGN-PC-0WA6XY) |
| Chemical Name | 2-Methyl-4-(2-nitrophenyl)thiazole |
| IUPAC Name | 2-methyl-4-(2-nitrophenyl)-1,3-thiazole |
| InChI | InChI=1S/C10H8N2O2S/c1-7-11-9(6-15-7)8-4-2-3-5-10(8)12(13)14/h2-6H,1H3 |
| InChI Key | CDIYPVIYTJKKOR-UHFFFAOYSA-N |
| MDL Number | MFCD22383785 |
| Molecular Formula | C10H8N2O2S |
| Molecular Weight | 220.2477 |
| SMILES | Cc1scc(n1)c1ccccc1[N+](=O)[O-] |
| Synonyms | 2-Methyl-4-(2-nitrophenyl)thiazole,
305811-37-4,
ACMC-209hh6,
SCHEMBL6367549,
CTK8B1421,
DTXSID20626160,
ANW-26920,
MFCD22383785,
ZINC85479273,
AM90086,
2-Methyl-4-(2-nitro-phenyl)-thiazole,
Thiazole, 2-methyl-4-(2-nitrophenyl)-,
2-methyl-4-(2-nitrophenyl)-1,3-thiazole,
AJ-127834,
AX8255748,
TC-115665,
V5042,
C10H8N2O2S,
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| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.246g/mol |
| Monoisotopic Mass | 220.031g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 87A^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