2-(2-(2-Aminoethoxy)ethoxy)ethane-1-thiol
Basic information
- CAS
948039-59-6- Standard SMILES
NCCOCCOCCS- InChIKey
FNNONORWBCKUPH-UHFFFAOYSA-N- Molecular formula
- C6H15NO2S
- Average molar mass
- 165.26 g/mol
Names & identifiers
- Preferred name
- 2-(2-(2-Aminoethoxy)ethoxy)ethane-1-thiol
- IUPAC
- 2-[2-(2-aminoethoxy)ethoxy]ethanethiol
- English name
- Ethanethiol, 2-[2-(2-aminoethoxy)ethoxy]-
- Molecular formula
- C6H15NO2S
- Molecular weight
- 165.25
Names & synonyms
948039-59-62-(2-(2-Aminoethoxy)ethoxy)ethane-1-thiolS5Yorb3177999SCHEMBL7941951AKOS030213443Ethanethiol, 2-[2-(2-aminoethoxy)ethoxy]-Thiol-PEG2-NH2Amino-PEG3-ThiolSH-PEG2-CH2CH2NH2
Database identifiers
- CAS
948039-59-6
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 45.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 63.7
Physicochemical properties
- Boiling point
- 256.2 · 256.2±25.0 °C(Predicted)
- Density
- 1.045 · 1.045±0.06 g/cm3(Predicted)
- pka
- 9.65 · 9.65±0.10(Predicted)
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Compound notes
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