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1-Benzyl-4-((4-chlorophenyl)sulfonyl)piperazine

HCID 985373
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Basic information

CAS
324067-21-2
Standard SMILES
O=S(=O)(c1ccc(Cl)cc1)N1CCN(Cc2ccccc2)CC1
InChIKey
CJZZSVCCBZWMCS-UHFFFAOYSA-N
Molecular formula
C17H19ClN2O2S
Average molar mass
350.9 g/mol
Monoisotopic mass
350.0855767

Names & identifiers

Preferred name
1-Benzyl-4-((4-chlorophenyl)sulfonyl)piperazine
IUPAC
1-benzyl-4-(4-chlorophenyl)sulfonylpiperazine

Names & synonyms

324067-21-21-benzyl-4-((4-chlorophenyl)sulfonyl)piperazine1-benzyl-4-(4-chlorobenzenesulfonyl)piperazine4-CHLORO-1-((4-BENZYLPIPERAZINYL)SULFONYL)BENZENECHEMBL23910751-benzyl-4-(4-chlorophenyl)sulfonylpiperazine1-benzyl-4-[(4-chlorophenyl)sulfonyl]piperazineF0869-00304-chloro-1-{[4-benzylpiperazinyl]sulfonyl}benzeneCerep_004435MFCD00784577Maybridge1_006963
Show more names
1-Benzyl-4-(4-chloro-benzenesulfonyl)-piperazineOprea1_055856Oprea1_408364SCHEMBL5249650HMS539N17HMS561E11SMSSF-0011488BDBM50435877

Database identifiers

CAS
324067-21-2
PubChem CID
985373
ChEMBL
CHEMBL2391075
EC Number
141-504-1

Properties

Computed structural properties

XLogP
3
Topological polar surface area
49 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
Formal charge
0
Complexity
457

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

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Compound notes

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