Basic information
- Standard SMILES
CC(O)OCCCCOC(C)O- InChIKey
XRWDMALEHYCFOS-UHFFFAOYSA-N- Molecular formula
- C8H18O4
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.12050905
Names & identifiers
- Preferred name
- 1,4-Butane diol di(1-hydroxyethyl) ether
- IUPAC
- 1-[4-(1-hydroxyethoxy)butoxy]ethanol
Names & synonyms
XRWDMALEHYCFOS-UHFFFAOYSA-N1,4-butane diol di(1-hydroxyethyl) ether
Database identifiers
- PubChem CID
- 85990296
- Nikkaji
- J3.644.424J
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 85
Related reactions
1 records
Compound notes
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