Basic information
- CAS
436852-26-5- Standard SMILES
Cl.Cl.O=S1(=O)CCC(N2CCNCC2)C1- InChIKey
QYFABGRAQQENFF-UHFFFAOYSA-N- Molecular formula
- C8H18Cl2N2O2S
- Average molar mass
- 277.21 g/mol
- Monoisotopic mass
- 276.0466044
Names & identifiers
- Preferred name
- 1-(Tetrahydro-1,1-dioxido-3-thienyl)piperazine dihydrochloride
- IUPAC
- 3-piperazin-1-ylthiolane 1,1-dioxide;dihydrochloride
- English name
- 3-piperazin-1-ylthiolane 1,1-dioxide dihydrochloride
- Molecular formula
- C8H17ClN2O2S
- Molecular weight
- 240.75
Names & synonyms
436852-26-5RefChem:4287231-(Tetrahydro-1,1-dioxido-3-thienyl)piperazine dihydrochloride841-639-21-(1,1-DIOXIDOTETRAHYDRO-3-THIENYL)PIPERAZINE DIHYDROCHLORIDE1-(1,1-dioxidotetrahydrothien-3-yl)piperazine dihydrochloride3-(Piperazin-1-yl)tetrahydrothiophene 1,1-dioxide dihydrochlorideMFCD066712641-(1,1-Dioxidotetrahydrothien-3-yl)piperazine DiHCl3-piperazin-1-ylthiolane 1,1-dioxide;dihydrochlorideSCHEMBL5889126AKOS026744024
Show more names
3-piperazin-1-ylthiolane 1,1-dioxide dihydrochloride3-(piperazin-1-yl)-1-thiolane-1,1-dione dihydrochloride3-(piperazin-1-yl)-1lambda6-thiolane-1,1-dione dihydrochloride
CS-0308801EN300-13307E72823F718662SR-010000516771-(1,1-dioxidotetrahydro-3-thienyl)piperazine 2HClSR-01000051677-11-(1,1-Dioxidotetrahydro-3-thienyl)piperazine diHCl
Database identifiers
Properties
Computed structural properties
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers6 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
COMBI-BLOCKS[email protected]
CHEMBRDG-BB[email protected]
IFLAB-BB[email protected]
PRINCETON[email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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