Basic information
- CAS
756859-05-9- Standard SMILES
O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1CCNCC1- InChIKey
YNZSAWALMDCRMX-UHFFFAOYSA-N- Molecular formula
- C11H13F3N2O3S
- Average molar mass
- 310.29 g/mol
- Monoisotopic mass
- 310.05989794
Names & identifiers
- Preferred name
- 1-[4-(Trifluoromethoxy)benzenesulfonyl]piperazine
- IUPAC
- 1-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine
- English name
- 1-[[4-(TRIFLUOROMETHOXY)PHENYL]SULFONYL]PIPERAZINE
- Molecular formula
- C11H13F3N2O3S
- Molecular weight
- 310.29
Names & synonyms
756859-05-91-[4-(TRIFLUOROMETHOXY)BENZENESULFONYL]PIPERAZINE1-{[4-(trifluoromethoxy)phenyl]sulfonyl}piperazine1-[[4-(trifluoromethoxy)phenyl]sulfonyl]Piperazine1-((4-(Trifluoromethoxy)phenyl)sulfonyl)piperazinePiperazine, 1-[[4-(trifluoromethoxy)phenyl]sulfonyl]-1-[4-(trifluoromethoxy)phenyl]sulfonylpiperazineChemDiv3_011706SCHEMBL309646SCHEMBL22971321-({4-[(trifluoromethyl)oxy]phenyl}sulfonyl)piperazine1-(4-TRIFLUOROMETHOXY-BENZENESULFONYL)-PIPERAZINE
Show more names
DTXSID00366471HMS1506E02AKOS000117567IDI1_029264DB-075008CS-0352069EN300-099721-{[4-(trifluoromethoxy)benzene]sulfonyl}piperazine
Database identifiers
- CAS
756859-05-9- PubChem CID
- 2079402
- DTXSID
DTXSID00366471
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 67 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 408
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers5 total
Ryan Scientific, Inc.[email protected]
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
ENAMINE-CHI[email protected]
UKRORGSYN-BB[email protected]
Related reactions
8 records
Compound notes
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