| CAS Number | 1909312-28-2 |
| Catalog Number | AG01C4Y9 |
| Chemical Name | [4-(1,3-oxazol-5-yl)phenyl]methanamine dihydrochloride |
| IUPAC Name | [4-(1,3-oxazol-5-yl)phenyl]methanamine;dihydrochloride |
| InChI | InChI=1S/C10H10N2O.2ClH/c11-5-8-1-3-9(4-2-8)10-6-12-7-13-10;;/h1-4,6-7H,5,11H2;2*1H |
| InChI Key | JOUOOIODCGZOKF-UHFFFAOYSA-N |
| MDL Number | MFCD29907037 |
| Molecular Formula | C10H12Cl2N2O |
| Molecular Weight | 247.1211 |
| SMILES | Cl.Cl.NCC1=CC=C(C2OC=NC=2)C=C1 |
| Synonyms | [4-(1,3-oxazol-5-yl)phenyl]methanamine dihydrochloride,
1909312-28-2,
Z2418193612,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.119g/mol |
| Monoisotopic Mass | 246.033g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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