Ethanediol, hexylboronate
Basic information
- CAS
88686-82-2- Standard SMILES
CCCCCCB1SCCS1- InChIKey
ORLRWYSMQRMPIM-UHFFFAOYSA-N- Molecular formula
- C8H17BS2
- Average molar mass
- 188.2 g/mol
- Monoisotopic mass
- 188.0864731
Names & identifiers
- Preferred name
- Ethanediol, hexylboronate
- IUPAC
- 2-hexyl-1,3,2-dithiaborolane
Names & synonyms
Ethanediol, hexylboronate88686-82-2DTXSID10336089RefChem:340118DTXCID60287178ORLRWYSMQRMPIM-UHFFFAOYSA-N2-hexyl-1,3,2-dithiaborolane
Database identifiers
- CAS
88686-82-2- PubChem CID
- 529046
- DTXSID
DTXSID10336089- Nikkaji
- J2.050.733K
Properties
Computed structural properties
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 92.1
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Compound notes
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