| CAS Number | 39640-05-6 |
| Catalog Number | AG00I7SM(AGN-PC-00VQCQ) |
| Chemical Name | Piperazin-1-yl(pyridin-4-yl)methanone dihydrochloride |
| IUPAC Name | piperazin-1-yl(pyridin-4-yl)methanone;dihydrochloride |
| InChI | InChI=1S/C10H13N3O.2ClH/c14-10(9-1-3-11-4-2-9)13-7-5-12-6-8-13;;/h1-4,12H,5-8H2;2*1H |
| InChI Key | QBPKUQIUNJYTGA-UHFFFAOYSA-N |
| MDL Number | MFCD06800823 |
| Molecular Formula | C10H15Cl2N3O |
| Molecular Weight | 264.1516 |
| SMILES | Cl.Cl.O=C(C1=CC=NC=C1)N1CCNCC1 |
| Synonyms | piperazin-1-yl(pyridin-4-yl)methanone dihydrochloride,
39640-05-6,
1-isonicotinoylpiperazine dihydrochloride,
1-Isonicotinoylpiperazine DiHCl,
C10H13N3O.2ClH,
Piperazin-1-yl(pyridin-4-yl)methanonedihydrochloride,
AC1Q3B03,
SCHEMBL1597605,
CTK8C5235,
ANW-74873,
MFCD07687282,
AKOS016008458,
MCULE-3339198424,
TC-163618,
FT-0695937,
V5701,
EN300-15278,
1-(pyridine-4-carbonyl)piperazine dihydrochloride,
A824666,
1-piperazinyl(pyridin-4-yl)methanone dihydrochloride,
39640-04-5,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.15g/mol |
| Monoisotopic Mass | 263.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number