| CAS Number | 1883347-27-0 |
| Catalog Number | AG002GU2(AGN-PC-0WAMCZ) |
| Chemical Name | 2-Methyloctahydro-1H-Pyrazino[1,2-a]Pyrazine Trihydrochloride |
| IUPAC Name | 2-methyl-1,3,4,6,7,8,9,9a-octahydropyrazino[1,2-a]pyrazine;trihydrochloride |
| InChI | InChI=1S/C8H17N3.3ClH/c1-10-4-5-11-3-2-9-6-8(11)7-10;;;/h8-9H,2-7H2,1H3;3*1H |
| InChI Key | JUMKBBXIMDOSTJ-UHFFFAOYSA-N |
| MDL Number | MFCD29044908 |
| Molecular Formula | C8H20Cl3N3 |
| Molecular Weight | 264.6235 |
| SMILES | CN1CC(CNCC2)N2CC1.[H]Cl.[H]Cl.[H]Cl |
| Synonyms | 2-Methyloctahydro-1H-pyrazino[1,2-a]pyrazine trihydrochloride,
1883347-27-0,
AK174415,
KS-00000T4L,
MFCD29044908,
AKOS025404724,
DS-8725,
2H-Pyrazino[1,2-a]pyrazine, octahydro-2-methyl-, hydrochloride (1:3),
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.619g/mol |
| Monoisotopic Mass | 263.072g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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