| CAS Number | 95199-93-2 |
| Catalog Number | AG01A9N4(AGN-PC-00M70L) |
| Chemical Name | 3-Butyl-1,2-oxazol-5-amine |
| IUPAC Name | 3-butyl-1,2-oxazol-5-amine |
| InChI | InChI=1S/C7H12N2O/c1-2-3-4-6-5-7(8)10-9-6/h5H,2-4,8H2,1H3 |
| InChI Key | PPJWTTNPKXVXCK-UHFFFAOYSA-N |
| MDL Number | MFCD08694509 |
| Molecular Formula | C7H12N2O |
| Molecular Weight | 140.1830 |
| SMILES | CCCCC1=NOC(N)=C1 |
| Synonyms | 3-butyl-1,2-oxazol-5-amine,
95199-93-2,
AC1Q2VLC,
ZINC26515336,
AKOS000280701,
MCULE-4931820724,
NE28886,
EN300-65578,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.186g/mol |
| Monoisotopic Mass | 140.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number