Basic information
- CAS
926-40-9- Standard SMILES
CCCSC(C)(C)C- InChIKey
MTVMGLPBDYLGDV-UHFFFAOYSA-N- Molecular formula
- C7H16S
- Average molar mass
- 132.27 g/mol
- Monoisotopic mass
- 132.09727168
Names & identifiers
- Preferred name
- Tert-butyl propyl sulfide
- IUPAC
- 2-methyl-2-propylsulfanylpropane
Names & synonyms
926-40-9NSC 99112tert-butyl propyl sulfide2-methyl-2-(propylsulfanyl)propanet-BUTYL PROPYL SULFIDENSC99112t-Butyl n-propyl sulfideSCHEMBL1704306SCHEMBL2964365SCHEMBL6569959SCHEMBL7593082SCHEMBL8744941
Show more names
(1,1-dimethylethyl)propylsulfideDTXSID80294985MTVMGLPBDYLGDV-UHFFFAOYSA-NNSC-99112AKOS006242925
Database identifiers
- CAS
926-40-9- PubChem CID
- 264183
- DTXSID
DTXSID80294985- Nikkaji
- J463.674K
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 51.9
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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