| CAS Number | 893747-69-8 |
| Catalog Number | AG00GS0V(AGN-PC-0WOBBT) |
| Chemical Name | 1-(2-methylpropyl)piperazin-2-one |
| IUPAC Name | 1-(2-methylpropyl)piperazin-2-one |
| InChI | InChI=1S/C8H16N2O/c1-7(2)6-10-4-3-9-5-8(10)11/h7,9H,3-6H2,1-2H3 |
| InChI Key | YULBVDIZTAMXKS-UHFFFAOYSA-N |
| MDL Number | MFCD06803966 |
| Molecular Formula | C8H16N2O |
| Molecular Weight | 156.2254 |
| SMILES | CC(CN1C(=O)CNCC1)C |
| Synonyms | 1-(2-methylpropyl)piperazin-2-one,
893747-69-8,
SCHEMBL1583866,
1-ISOBUTYL-PIPERAZIN-2-ONE,
ZINC16944214,
2-Piperazinone,1-(2-methylpropyl)-,
AKOS003656031,
AB30264,
NE26057,
BB 0220718,
FT-0709261,
2-PIPERAZINONE, 1-(2-METHYLPROPYL)-,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.229g/mol |
| Monoisotopic Mass | 156.126g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number