| CAS Number | 1049791-62-9 |
| Catalog Number | AG00HAK4(AGN-PC-0WR4K8) |
| Chemical Name | 1-(2-chlorobenzenesulfonyl)piperazine hydrochloride |
| IUPAC Name | 1-(2-chlorophenyl)sulfonylpiperazine;hydrochloride |
| InChI | InChI=1S/C10H13ClN2O2S.ClH/c11-9-3-1-2-4-10(9)16(14,15)13-7-5-12-6-8-13;/h1-4,12H,5-8H2;1H |
| InChI Key | AUVCTUBDAGMLJY-UHFFFAOYSA-N |
| MDL Number | MFCD07308366 |
| Molecular Formula | C10H14Cl2N2O2S |
| Molecular Weight | 297.2014 |
| SMILES | Cl.ClC1=C(S(N2CCNCC2)(=O)=O)C=CC=C1 |
| Synonyms | 1049791-62-9,
1-(2-chlorobenzenesulfonyl)piperazine hydrochloride,
1-[(2-chlorophenyl)sulfonyl]piperazine hydrochloride,
AC1Q3B8B,
CTK6H3498,
MFCD07308366,
AKOS026852195,
MCULE-2947751084,
NE32928,
1-[(2-Chlorophenyl)sulfonyl]piperazine, HCl,
EN300-10727,
SR-01000057106,
SR-01000057106-1,
Z57018856,
|
| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 296.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.194g/mol |
| Monoisotopic Mass | 296.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number