(2S,5S)-2-Methyl-5-propan-2-yl-1,3-oxathiane
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Basic information
- CAS
110523-71-2- Standard SMILES
CC(C)[C@H]1CO[C@H](C)SC1- InChIKey
JSHXMLHPTWVJRP-YUMQZZPRSA-N- Molecular formula
- C8H16OS
- Average molar mass
- 160.28 g/mol
Names & identifiers
- Preferred name
- (2S,5S)-2-Methyl-5-propan-2-yl-1,3-oxathiane
- IUPAC
- (2S,5S)-2-methyl-5-propan-2-yl-1,3-oxathiane
- English name
- 1,3-Oxathiane,2-methyl-5-(1-methylethyl)-,trans-(9CI)
- Molecular formula
- C8H16OS
- Molecular weight
- 160.28
Names & synonyms
(2S,5S)-2-Methyl-5-propan-2-yl-1,3-oxathiane110523-71-21,3-Oxathiane,2-methyl-5-(1-methylethyl)-,trans-(9CI)
Database identifiers
- CAS
110523-71-2
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Related reactions
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Compound notes
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