| CAS Number | 851726-91-5 |
| Catalog Number | AG00G92W(AGN-PC-0A0KD2) |
| Chemical Name | 1,6-Dimethylpiperazin-2-one |
| IUPAC Name | 1,6-dimethylpiperazin-2-one |
| InChI | InChI=1S/C6H12N2O/c1-5-3-7-4-6(9)8(5)2/h5,7H,3-4H2,1-2H3 |
| InChI Key | ILWSUADBJSOIGH-UHFFFAOYSA-N |
| MDL Number | MFCD14707893 |
| Molecular Formula | C6H12N2O |
| Molecular Weight | 128.1723 |
| SMILES | CC1N(C)C(=O)CNC1 |
| Synonyms | 1,6-dimethyl-2-Piperazinone,
1,6-Dimethylpiperazin-2-one,
851726-91-5,
(R)-1,6-Dimethylpiperazin-2-one,
2-Piperazinone,1,6-dimethyl-,
SCHEMBL4750655,
ILWSUADBJSOIGH-UHFFFAOYSA-N,
1657077-47-8,
AKOS006378499,
DA-02749,
FT-0751007,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.175g/mol |
| Monoisotopic Mass | 128.095g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number