| CAS Number | 1016833-15-0 |
| Catalog Number | AG019YL4(AGN-PC-0WO36J) |
| Chemical Name | 2-(methoxymethyl)-1,3-benzoxazol-5-amine |
| IUPAC Name | 2-(methoxymethyl)-1,3-benzoxazol-5-amine |
| InChI | InChI=1S/C9H10N2O2/c1-12-5-9-11-7-4-6(10)2-3-8(7)13-9/h2-4H,5,10H2,1H3 |
| InChI Key | KGPCXOZANCWUBB-UHFFFAOYSA-N |
| MDL Number | MFCD09942764 |
| Molecular Formula | C9H10N2O2 |
| Molecular Weight | 178.1879 |
| SMILES | COCC1OC2=C(C=C(C=C2)N)N=1 |
| Synonyms | 2-(methoxymethyl)-1,3-benzoxazol-5-amine,
1016833-15-0,
ZINC19488706,
AKOS000186326,
MCULE-7776206940,
NE25718,
Z1354487571,
(5-amino-1,3-benzoxazol-2-yl)methanethiol,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.191g/mol |
| Monoisotopic Mass | 178.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number