3-Bromo-4-methyl-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
Basic information
- CAS
65017-48-3- Standard SMILES
CC1=CS(=O)(=O)CC1Br- InChIKey
DEUTYJVGWAZEKM-UHFFFAOYSA-N- Molecular formula
- C5H7BrO2S
- Average molar mass
- 211.08 g/mol
- Monoisotopic mass
- 209.93501
Names & identifiers
- Preferred name
- 3-Bromo-4-methyl-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
- IUPAC
- 3-bromo-4-methyl-2,3-dihydrothiophene 1,1-dioxide
- English name
- 3-Bromo-4-methyl-2,3-dihydro-1H-1lambda6-thiophene-1,1-dione
- Molecular formula
- C5H7BrO2S
- Molecular weight
- 211.08
Names & synonyms
65017-48-3DTXSID103366653-bromo-4-methyl-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dioneRefChem:277478DTXCID002877533-bromo-4-methyl-2,3-dihydrothiophene 1,1-dioxide3-bromo-4-methyl-2,3-dihydro-1lambda6-thiophene-1,1-dione3-Bromo-4-methyl-2,3-dihydro-thiophene 1,1-dioxideDEUTYJVGWAZEKM-UHFFFAOYSA-NAKOS002663622AKOS016043875DB-366164
Show more names
IFLAB-BB F1068-0035Thiophene, 3-bromo-2,3-dihydro-4-methyl-, 1,1-dioxide3-Bromo-4-methyl-2,3-dihydro-1H-1lambda6-thiophene-1,1-dione
CS-0282179EN300-2357783-bromo-4-methyl-2,3-dihydro-1-thiophene-1,1-dioneF1068-00353-bromo-4-methyl-2,3-dihydro-1lambda-thiophene-1,1-dione
Database identifiers
- CAS
65017-48-3- PubChem CID
- 535288
- DTXSID
DTXSID10336665
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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