| CAS Number | 89102-78-3 |
| Catalog Number | AG003ZM0(AGN-PC-003EKR) |
| Chemical Name | 5-(chloromethyl)-2-phenyl-1,3-oxazole |
| IUPAC Name | 5-(chloromethyl)-2-phenyl-1,3-oxazole |
| InChI | InChI=1S/C10H8ClNO/c11-6-9-7-12-10(13-9)8-4-2-1-3-5-8/h1-5,7H,6H2 |
| InChI Key | CDMTXVZVZBKYIC-UHFFFAOYSA-N |
| MDL Number | MFCD20627571 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | ClCC1OC(C2=CC=CC=C2)=NC=1 |
| Synonyms | 89102-78-3,
5-(chloromethyl)-2-phenyloxazole,
Oxazole, 5-(chloromethyl)-2-phenyl-,
5-(Chloromethyl)-2-phenyl-1,3-oxazole,
ACMC-20lhqh,
SCHEMBL9863750,
5-Chloromethyl-2-phenyl oxazole,
CTK3A1404,
DTXSID20567160,
CDMTXVZVZBKYIC-UHFFFAOYSA-N,
ZINC34437361,
AKOS030632116,
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| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.63g/mol |
| Monoisotopic Mass | 193.029g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number