ST50990768
Basic information
- CAS
17113-41-6- Standard SMILES
CC(C)=C1C=CC(=C(C)C)S1(=O)=O- InChIKey
LDRLQUJSTFBUPJ-UHFFFAOYSA-N- Molecular formula
- C10H14O2S
- Average molar mass
- 198.28 g/mol
- Monoisotopic mass
- 198.07145086
Names & identifiers
- Preferred name
- ST50990768
- IUPAC
- 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide
Names & synonyms
17113-41-6ST50990768DTXSID40355243RefChem:381750DTXCID10306303Thiophene, 2,5-dihydro-2,5-bis(1-methylethylidene)-, 1,1-dioxide2,5-di(propan-2-ylidene)thiophene 1,1-dioxideCambridge id 5318493CCG-2538AKOS0243607882,5-bis(methylethylidene)thiolene-1,1-dione2,5-bis(1-methylethylidene)-2,5-dihydrothiophene 1,1-dioxide
Show more names
2,5-Di(propan-2-ylidene)-2,5-dihydro-1H-1lambda~6~-thiophene-1,1-dione
Database identifiers
- CAS
17113-41-6- PubChem CID
- 794645
- DTXSID
DTXSID40355243
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 372
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Compound notes
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