Basic information
- CAS
73909-05-4- Standard SMILES
N#CSC1C=CS(=O)(=O)C1- InChIKey
FPVZCZACFVXKAJ-UHFFFAOYSA-N- Molecular formula
- C5H5NO2S2
- Average molar mass
- 175.2 g/mol
- Monoisotopic mass
- 174.97617075
Names & identifiers
- Preferred name
- Thiophene, 2,3-dihydro-3-thiocyanato-, 1,1-dioxide
- IUPAC
- (1,1-dioxo-2,3-dihydrothiophen-3-yl) thiocyanate
- English name
- 3-thiocyanato-2,3-dihydrothiophene 1,1-dioxide
- Molecular formula
- C5H5NO2S2
- Molecular weight
- 175.23
Names & synonyms
73909-05-4Thiophene, 2,3-dihydro-3-thiocyanato-, 1,1-dioxideRefChem:1100010(1,1-dioxo-2,3-dihydrothiophen-3-yl) thiocyanate1,1-Dioxido-2,3-dihydro-3-thienyl thiocyanate[(1,1-dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)sulfanyl]formonitrileF0802-0025(1,1-dioxo(3-2,3-dihydrothienyl))thiocarbonitrileNSC 2024921,1-Dioxo-2,3-dihydro-3-thienyl thiocyanate2,3-Dihydro-3-thiocyanatothiophene 1,1-dioxideNSC202492
Show more names
3-thiocyanato-2,3-dihydrothiophene 1,1-dioxide2,3-DIHYDRO-3-THIOCYANATOTHIOPHENE-1,1-DIOXIDEThiocyanic acid, 2,3-dihydro-1,1-dioxido-3-thienyl ester
Thiocyanic acid, 2,3-dihydro-3-thienyl ester, S,S-dioxideOprea1_334844IFLab1_003612SCHEMBL3082298DTXSID401385047HMS1422E041,3-dihydro-3-thienyl thiocyanateSMSSF-0060640
Database identifiers
- CAS
73909-05-4
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 289
Physicochemical properties
- Boiling point
- 457.6 · 457.6±45.0 °C(Predicted)
- Density
- 1.52 · 1.52±0.1 g/cm3(Predicted)
Chemistry & industry
Suppliers5 total
LeadGen Labs, LLC[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
SPECS[email protected]
IFLAB-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…