| CAS Number | 1093215-83-8 |
| Catalog Number | AG01FE1J(AGN-PC-3H4A0O) |
| Chemical Name | 2-(4-Nitrophenyl)-4-phenylthiazole |
| IUPAC Name | 2-(4-nitrophenyl)-4-phenyl-1,3-thiazole |
| InChI | InChI=1S/C15H10N2O2S/c18-17(19)13-8-6-12(7-9-13)15-16-14(10-20-15)11-4-2-1-3-5-11/h1-10H |
| InChI Key | HKDYAFOUJMMNGN-UHFFFAOYSA-N |
| MDL Number | MFCD27978262 |
| Molecular Formula | C15H10N2O2S |
| Molecular Weight | 282.3171 |
| SMILES | S1C=C(C2C=CC=CC=2)N=C1C1C=CC([N+]([O-])=O)=CC=1 |
| Synonyms | 2-(4-Nitrophenyl)-4-phenylthiazole,
1093215-83-8,
ZINC48640635,
AKOS008776637,
2-(4-Nitrophenyl)-4-phenyl-thiazole, AldrichCPR,
|
| Complexity | 333 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.317g/mol |
| Monoisotopic Mass | 282.046g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 87A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
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Certificate of Analysis
Lot Number