| CAS Number | 1256642-93-9 |
| Catalog Number | AG009DRH(AGN-PC-0WB5WJ) |
| Chemical Name | 2-Methylhexahydro-2H-pyrazino[1,2-a]pyrazin-1(6H)-one |
| IUPAC Name | 2-methyl-4,6,7,8,9,9a-hexahydro-3H-pyrazino[1,2-a]pyrazin-1-one |
| InChI | InChI=1S/C8H15N3O/c1-10-4-5-11-3-2-9-6-7(11)8(10)12/h7,9H,2-6H2,1H3 |
| InChI Key | AQERSHFVJCXUDR-UHFFFAOYSA-N |
| MDL Number | MFCD18381898 |
| Molecular Formula | C8H15N3O |
| Molecular Weight | 169.2242 |
| SMILES | CN1C(C2N(CC1)CCNC2)=O |
| Synonyms | 1256642-93-9,
2-Methyloctahydro-1H-pyrazino[1,2-a]pyrazin-1-one,
2-methylhexahydro-2H-pyrazino[1,2-a]pyrazin-1(6H)-one,
SCHEMBL16931754,
AQERSHFVJCXUDR-UHFFFAOYSA-N,
ZX-CM008700,
FCH898563,
MFCD18381898,
AKOS006316690,
Y-7873,
2-methylhexahydro-2H-pyrazino[1,2-a]pyrazin-1(6H)-one(SALTDATA,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.228g/mol |
| Monoisotopic Mass | 169.122g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number