| CAS Number | 73498-24-5 |
| Catalog Number | AG005NBR(AGN-PC-09LISM) |
| Chemical Name | 5-Chloro-1,2-benzoxazol-3-amine |
| IUPAC Name | 5-chloro-1,2-benzoxazol-3-amine |
| InChI | InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)7(9)10-11-6/h1-3H,(H2,9,10) |
| InChI Key | TVQGEMZMXVGMCR-UHFFFAOYSA-N |
| MDL Number | MFCD09999136 |
| Molecular Formula | C7H5ClN2O |
| Molecular Weight | 168.5804 |
| SMILES | NC1C2=C(C=CC(=C2)Cl)ON=1 |
| Synonyms | 5-chlorobenzo[d]isoxazol-3-amine,
73498-24-5,
5-chloro-benzo[d]isoxazol-3-ylamine,
5-CHLORO-1,2-BENZOXAZOL-3-AMINE,
SCHEMBL481909,
CTK8D4172,
DTXSID50680538,
TVQGEMZMXVGMCR-UHFFFAOYSA-N,
ZINC67175723,
AKOS017518125,
5-CHLOROBENZO[D]ISOXAZOL-3-YLAMINE,
TC-070096,
Z2189283751,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.58g/mol |
| Monoisotopic Mass | 168.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number