| CAS Number | 1390654-29-1 |
| Catalog Number | AG00J19K(AGN-PC-0WB6XD) |
| Chemical Name | 2-(2-Aminoethyl)-6-methylpyrimidin-4-ol dihydrochloride |
| IUPAC Name | 2-(2-aminoethyl)-4-methyl-1H-pyrimidin-6-one;dihydrochloride |
| InChI | InChI=1S/C7H11N3O.2ClH/c1-5-4-7(11)10-6(9-5)2-3-8;;/h4H,2-3,8H2,1H3,(H,9,10,11);2*1H |
| InChI Key | CBBAOLMVDMJTHR-UHFFFAOYSA-N |
| MDL Number | MFCD09864290 |
| Molecular Formula | C7H13Cl2N3O |
| Molecular Weight | 226.1036 |
| SMILES | N1=C(O)C=C(N=C1CCN)C.Cl.Cl |
| Synonyms | 1390654-29-1,
2-(2-Aminoethyl)-6-methyl-4-pyrimidinol dihydrochloride,
2-(2-Aminoethyl)-6-methylpyrimidin-4-ol dihydrochloride,
ZX-CM003572,
MFCD09864290,
AKOS027426402,
2-(2-Aminoethyl)-6-methylpyrimidin-4-ol dihydrochloride, AldrichCPR,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.101g/mol |
| Monoisotopic Mass | 225.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number