Bis(3-hydroxypropyl)trisulfide
Basic information
- CAS
29229-36-5- Standard SMILES
OCCCSSSCCCO- InChIKey
YYBQKVULIKPELH-UHFFFAOYSA-N- Molecular formula
- C6H14O2S3
- Average molar mass
- 214.4 g/mol
- Monoisotopic mass
- 214.01559321
Names & identifiers
- Preferred name
- Bis(3-hydroxypropyl)trisulfide
- IUPAC
- 3-(3-hydroxypropyltrisulfanyl)propan-1-ol
- English name
- Bis(3-hydroxypropyl)trisulfide
- Molecular weight
- 0
Names & synonyms
Bis(3-hydroxypropyl)trisulfide29229-36-5DTXSID00183483RefChem:120122DTXCID101059743,3'-Trisulfanediylbis(propan-1-ol)1-Propanol, 3,3'-trithiobis-SCHEMBL44496943,3'-(Trisulfane-1,3-diyl)di(propan-1-ol)
Database identifiers
- CAS
29229-36-5- PubChem CID
- 3080752
- DTXSID
DTXSID00183483
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 64.8
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Related reactions
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Compound notes
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