| CAS Number | 5819-39-6 |
| Catalog Number | AG01DZNF(AGN-PC-01NUB8) |
| Chemical Name | 4-Chloro-5-methyl-isoxazol-3-ylamine |
| IUPAC Name | 4-chloro-5-methyl-1,2-oxazol-3-amine |
| InChI | InChI=1S/C4H5ClN2O/c1-2-3(5)4(6)7-8-2/h1H3,(H2,6,7) |
| InChI Key | DWVOVXRNQIXUEE-UHFFFAOYSA-N |
| MDL Number | MFCD11227222 |
| Molecular Formula | C4H5ClN2O |
| Molecular Weight | 132.5483 |
| SMILES | ClC=1C(=NOC1C)N |
| Synonyms | 4-Chloro-5-methyl-isoxazol-3-ylamine,
5819-39-6,
4-chloro-5-methyl-1,2-oxazol-3-amine,
4-Chloro-5-methylisoxazol-3-amine,
3-Amino-4-chloro-5-methylisoxazole,
4-chloro-5-methyl-3-aminoisoxazole,
SCHEMBL3189129,
CTK7E1564,
DWVOVXRNQIXUEE-UHFFFAOYSA-N,
KS-00003H2K,
4-Chloro-5-methylisoxazol-3-ylamine,
MFCD11227222,
SBB085826,
ZINC22129881,
4-chloro-5-methylisoxazole-3-ylamine,
AKOS006324138,
AS-5515,
TR-071933,
Z-1845,
|
| Complexity | 90.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.547g/mol |
| Monoisotopic Mass | 132.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number