| CAS Number | 885527-98-0 |
| Catalog Number | AG019PBZ(AGN-PC-0WOBMI) |
| Chemical Name | 1-(Piperazin-1-yl)cyclopentane-1-carbonitrile |
| IUPAC Name | 1-piperazin-1-ylcyclopentane-1-carbonitrile |
| InChI | InChI=1S/C10H17N3/c11-9-10(3-1-2-4-10)13-7-5-12-6-8-13/h12H,1-8H2 |
| InChI Key | OMZRBDHPZQUXQS-UHFFFAOYSA-N |
| MDL Number | MFCD07838471 |
| Molecular Formula | C10H17N3 |
| Molecular Weight | 179.2621 |
| SMILES | N#CC1(N2CCNCC2)CCCC1 |
| Synonyms | 1-(piperazin-1-yl)cyclopentane-1-carbonitrile,
1-piperazin-1-ylcyclopentanecarbonitrile,
885527-98-0,
AC1Q4QZ2,
CTK7C5690,
ZINC19803230,
AKOS000200438,
MCULE-7639550659,
EN300-23157,
1-piperazin-1-ylcyclopentanecarbonitrile, AldrichCPR,
Z166605504,
CID9397977,
1-piperazin-1-ylcyclopentane-1-carbonitrile,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.267g/mol |
| Monoisotopic Mass | 179.142g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number