| CAS Number | 787518-60-9 |
| Catalog Number | AG00G8IO(AGN-PC-0WOB1Y) |
| Chemical Name | 1-((Tetrahydro-2H-pyran-4-yl)methyl)piperazine |
| IUPAC Name | 1-(oxan-4-ylmethyl)piperazine |
| InChI | InChI=1S/C10H20N2O/c1-7-13-8-2-10(1)9-12-5-3-11-4-6-12/h10-11H,1-9H2 |
| InChI Key | XVQLGUIPBIHANF-UHFFFAOYSA-N |
| MDL Number | MFCD16745653 |
| Molecular Formula | C10H20N2O |
| Molecular Weight | 184.2786 |
| SMILES | C(N1CCNCC1)C1CCOCC1 |
| Synonyms | 1-(oxan-4-ylmethyl)piperazine,
787518-60-9,
1-((tetrahydro-2H-pyran-4-yl)methyl)piperazine,
SCHEMBL5745344,
1-[(oxan-4-yl)methyl]piperazine,
ZINC52170969,
AKOS011672955,
MCULE-1213287448,
NE18182,
DA-03311,
FT-0761766,
EN300-74598,
Piperazine, 1-[(tetrahydro-2H-pyran-4-yl)methyl]-,
F2147-1352,
Z1267773591,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.283g/mol |
| Monoisotopic Mass | 184.158g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 24.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number