| CAS Number | 167155-56-8 |
| Catalog Number | AG019KSS(AGN-PC-02T53R) |
| Chemical Name | 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-oxazole |
| IUPAC Name | 4-(chloromethyl)-2-(4-methoxyphenyl)-1,3-oxazole |
| InChI | InChI=1S/C11H10ClNO2/c1-14-10-4-2-8(3-5-10)11-13-9(6-12)7-15-11/h2-5,7H,6H2,1H3 |
| InChI Key | UUZBMZDVUFFUDE-UHFFFAOYSA-N |
| MDL Number | MFCD09403610 |
| Molecular Formula | C11H10ClNO2 |
| Molecular Weight | 223.6556 |
| SMILES | COC1=CC=C(C2OC=C(CCl)N=2)C=C1 |
| Synonyms | 4-(chloromethyl)-2-(4-methoxyphenyl)-1,3-oxazole,
167155-56-8,
AC1Q4AAQ,
SCHEMBL202974,
CTK7A3418,
UUZBMZDVUFFUDE-UHFFFAOYSA-N,
ZINC12505711,
AKOS009130534,
AB50581,
MCULE-6982331453,
NE14266,
SC-32705,
4-chloromethyl-2-(4-methoxy-phenyl)-oxazole,
EN300-28278,
Oxazole, 4-(chloromethyl)-2-(4-methoxyphenyl)-,
4-(CHLOROMETHYL)-2-(4-METHOXYPHENYL)OXAZOLE,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.656g/mol |
| Monoisotopic Mass | 223.04g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number