Basic information
- CAS
30140-46-6- Standard SMILES
CC(C)(C)c1ccc(C(C)(C)C)s1.CC(C)(C)c1ccsc1C(C)(C)C.CC(C)(C)c1cscc1C(C)(C)C- InChIKey
RSYKBKFUOILYBO-UHFFFAOYSA-N- Molecular formula
- C36H60S3
- Average molar mass
- 589.1 g/mol
- Monoisotopic mass
- 588.38571543
Names & identifiers
- Preferred name
- Thiophene, bis(1,1-dimethylethyl)-
- IUPAC
- 2,3-ditert-butylthiophene;2,5-ditert-butylthiophene;3,4-ditert-butylthiophene
Names & synonyms
Thiophene, bis(1,1-dimethylethyl)-30140-46-6BIS(1,1-DIMETHYLETHYL)THIOPHENEThiophene, di-tert-butyl-DTXSID50184223
Database identifiers
- CAS
30140-46-6- PubChem CID
- 34831
- DTXSID
DTXSID50184223
Properties
Computed structural properties
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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