| CAS Number | 252662-39-8 |
| Catalog Number | AG019SKC(AGN-PC-0WOA3T) |
| Chemical Name | (5-tert-Butyl-1,3-oxazol-2-yl)methanol |
| IUPAC Name | (5-tert-butyl-1,3-oxazol-2-yl)methanol |
| InChI | InChI=1S/C8H13NO2/c1-8(2,3)6-4-9-7(5-10)11-6/h4,10H,5H2,1-3H3 |
| InChI Key | YGORQZWUQNACLS-UHFFFAOYSA-N |
| MDL Number | MFCD12138053 |
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.1943 |
| SMILES | CC(C1OC(CO)=NC=1)(C)C |
| Synonyms | (5-tert-butyl-1,3-oxazol-2-yl)methanol,
252662-39-8,
SCHEMBL5724749,
2-hydroxymethyl-5-t-butyloxazole,
YGORQZWUQNACLS-UHFFFAOYSA-N,
ZINC36757697,
AKOS009591448,
NE39052,
Z1318186460,
(5-tert-butyloxazol-2-yl)methanol,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.197g/mol |
| Monoisotopic Mass | 155.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number