2,3-Dihydro-5,6-dimethyl-1,4-dithiin
Basic information
- CAS
22796-26-5- Standard SMILES
CC1=C(C)SCCS1- InChIKey
FAYLFGHUYPPDPQ-UHFFFAOYSA-N- Molecular formula
- C6H10S2
- Average molar mass
- 146.3 g/mol
- Monoisotopic mass
- 146.02239267
Names & identifiers
- Preferred name
- 2,3-Dihydro-5,6-dimethyl-1,4-dithiin
- IUPAC
- 5,6-dimethyl-2,3-dihydro-1,4-dithiine
- English name
- 2,3-dihydro-5,6-dimethyl-1,4-dithiin
- Molecular formula
- C6H10S2
- Molecular weight
- 146.2736
Names & synonyms
2,3-Dihydro-5,6-dimethyl-1,4-dithiin22796-26-51,4-Dithiin, 2,3-dihydro-5,6-dimethyl-EINECS 245-225-7783KQO0LRSUNII-783KQO0LRS2,3-dimethyl-5,6-dihydro-1,4-dithiinDTXSID80177345RefChem:81696DTXCID3099836245-225-75,6-dimethyl-2,3-dihydro-1,4-dithiine
Show more names
5,6-dimethyl-2,3-dihydro-1,4-p-dithiin
SCHEMBL3249657FAYLFGHUYPPDPQ-UHFFFAOYSA-N2,3-dimethyl-5,6-dihydro-[1,4]dithiineDB-239469NS00027261
Database identifiers
- CAS
22796-26-5- PubChem CID
- 89837
- DTXSID
DTXSID80177345- UNII
- 783KQO0LRS
- EC Number
- 245-225-7
- Nikkaji
- J286.310C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 102
Physicochemical properties
- FDA UNII
- 783 KQO0LRS · 783KQO0LRS
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1,4-Dithiin, 2,3-dihydro-5,6-dimethyl-
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Related reactions
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Compound notes
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