| CAS Number | 1158477-55-4 |
| Catalog Number | AG0090I0(AGN-PC-0WB67A) |
| Chemical Name | [2-(7-chloro-1,3-benzoxazol-2-yl)ethyl]amine hydrochloride |
| IUPAC Name | 2-(7-chloro-1,3-benzoxazol-2-yl)ethanamine;hydrochloride |
| InChI | InChI=1S/C9H9ClN2O.ClH/c10-6-2-1-3-7-9(6)13-8(12-7)4-5-11;/h1-3H,4-5,11H2;1H |
| InChI Key | RUMFLWHFRZXQJF-UHFFFAOYSA-N |
| MDL Number | MFCD11696442 |
| Molecular Formula | C9H10Cl2N2O |
| Molecular Weight | 233.0945 |
| SMILES | N1C2=CC=CC(Cl)=C2OC=1CCN.Cl |
| Synonyms | 2-(7-chloro-1,3-benzoxazol-2-yl)ethanamine hydrochloride,
1158477-55-4,
2-(7-Chlorobenzo[d]oxazol-2-yl)ethanamine hydrochloride,
CTK7E7656,
ZX-CM000425,
9625AC,
MFCD12030775,
AKOS015845868,
TR-057966,
2-(7-Chloro-1,3-benzoxazol-2-yl)ethanaminehydrochloride,
2-(7-Chloro-1,3-benzoxazol-2-yl)ethylamine hydrochloride,
C9H10Cl2N2O,
1119449-48-7,
N/A,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.092g/mol |
| Monoisotopic Mass | 232.017g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number