| CAS Number | 861020-53-3 |
| Catalog Number | AG003E04(AGN-PC-0J1HQF) |
| Chemical Name | 1-Benzyl-4-methylpiperazine 2hcl |
| IUPAC Name | 1-benzyl-4-methylpiperazine;dihydrochloride |
| InChI | InChI=1S/C12H18N2.2ClH/c1-13-7-9-14(10-8-13)11-12-5-3-2-4-6-12;;/h2-6H,7-11H2,1H3;2*1H |
| InChI Key | VUYMPKDDLSQBDC-UHFFFAOYSA-N |
| MDL Number | MFCD18711595 |
| Molecular Formula | C12H20Cl2N2 |
| Molecular Weight | 263.2066 |
| SMILES | CN1CCN(CC1)CC2=CC=CC=C2.Cl.Cl |
| Synonyms | 1-Benzyl-4-methylpiperazine Dihydrochloride,
861020-53-3,
1-BENZYL-4-METHYLPIPERAZINE 2HCL,
SCHEMBL11277255,
5064AJ,
MFCD18711595,
AKOS024438841,
TRA0061685,
AS-32656,
DA-02526,
SY014765,
FT-0751735,
Z-3579,
MFCD18711595 (97+%),
C12H18N2.2HCl,
ACN-025012,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.206g/mol |
| Monoisotopic Mass | 262.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 6.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number