| CAS Number | 1426904-72-4 |
| Catalog Number | AG00IZC5(AGN-PC-0WAYX5) |
| Chemical Name | 5-Tert-butyl-1,3-oxazole-4-carbohydrazide |
| IUPAC Name | 5-tert-butyl-1,3-oxazole-4-carbohydrazide |
| InChI | InChI=1S/C8H13N3O2/c1-8(2,3)6-5(7(12)11-9)10-4-13-6/h4H,9H2,1-3H3,(H,11,12) |
| InChI Key | RJUORJRQFRIWHZ-UHFFFAOYSA-N |
| MDL Number | MFCD23697496 |
| Molecular Formula | C8H13N3O2 |
| Molecular Weight | 183.2077 |
| SMILES | O=C(NN)C=1(N=COC=1C(C)(C)C) |
| Synonyms | 5-tert-butyl-1,3-oxazole-4-carbohydrazide,
1426904-72-4,
5-(tert-Butyl)oxazole-4-carbohydrazide,
KS-000023TS,
ZX-RL000713,
MFCD23697496,
ZINC91293278,
AKOS016028491,
CH-0709,
FCH2329018,
OR303222,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.211g/mol |
| Monoisotopic Mass | 183.101g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 81.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number