2-(2-Isopentoxyethoxy)ethanol
Basic information
- CAS
18912-82-8- Standard SMILES
CC(C)CCOCCOCCO- InChIKey
AVHNOTCXRFERQM-UHFFFAOYSA-N- Molecular formula
- C9H20O3
- Average molar mass
- 176.25 g/mol
- Monoisotopic mass
- 176.1412445
Names & identifiers
- Preferred name
- 2-(2-Isopentoxyethoxy)ethanol
- IUPAC
- 2-[2-(3-methylbutoxy)ethoxy]ethanol
Names & synonyms
2-(2-Isopentoxyethoxy)ethanol18912-82-82-(2-(Isopentyloxy)ethoxy)ethan-1-olSCHEMBL104224SCHEMBL28801259DTXSID40335747AVHNOTCXRFERQM-UHFFFAOYSA-N2-[2-(3-Methylbutoxy)ethoxy]ethan-1-ol
Database identifiers
- CAS
18912-82-8- PubChem CID
- 526896
- DTXSID
DTXSID40335747
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 83.8
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Compound notes
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