Basic information
- CAS
329937-53-3- Standard SMILES
O=S(=O)(c1ccc(Cl)cc1)N1CCN(c2cccc(Cl)c2)CC1- InChIKey
ZQPCZIANNZTUKO-UHFFFAOYSA-N- Molecular formula
- C16H16Cl2N2O2S
- Average molar mass
- 371.3 g/mol
- Monoisotopic mass
- 370.0309543
Names & identifiers
- Preferred name
- Piperazine, 1-(3-chlorophenyl)-4-[(4-chlorophenyl)sulfonyl]-
- IUPAC
- 1-(3-chlorophenyl)-4-(4-chlorophenyl)sulfonylpiperazine
- English name
- 1-(3-chlorophenyl)-4-[(4-chlorophenyl)sulfonyl]piperazine
- Molecular formula
- C16H16Cl2N2O2S
- Molecular weight
- 371.28
Names & synonyms
329937-53-3Piperazine, 1-(3-chlorophenyl)-4-[(4-chlorophenyl)sulfonyl]-Piperazine, 1-(3-chlorophenyl)-4-((4-chlorophenyl)sulfonyl)-RefChem:3722631-(3-chlorophenyl)-4-[(4-chlorophenyl)sulfonyl]piperazine1-(4-Chlorobenzene-1-sulfonyl)-4-(3-chlorophenyl)piperazineCambridge id 5355022Oprea1_190966Oprea1_805711AK-968/11164570SCHEMBL52497121-(3-chlorophenyl)-4-(4-chlorophenyl)sulfonylpiperazine
Show more names
1-(4-CHLORO-BENZENESULFONYL)-4-(3-CHLORO-PHENYL)-PIPERAZINE
DTXSID101184830STK068755AKOS001648246CCG-110352ST010520EU-0043157AB00082567-01AG-690/12883904
Database identifiers
- CAS
329937-53-3- PubChem CID
- 985376
- DTXSID
DTXSID101184830
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 49 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 481
Physicochemical properties
- Boiling point
- 531.9 · 531.9±60.0 °C(Predicted)
- Density
- 1.406 · 1.406±0.06 g/cm3(Predicted)
- pka
- 3.71 · 3.71±0.40(Predicted)
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
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%)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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