2-(4-Aminobutylamino)ethanol
Basic information
- CAS
23563-86-2- Standard SMILES
NCCCCNCCO- InChIKey
FJAOJVGLIUIDIX-UHFFFAOYSA-N- Molecular formula
- C6H16N2O
- Average molar mass
- 132.2 g/mol
- Monoisotopic mass
- 132.12626314
Names & identifiers
- Preferred name
- 2-(4-Aminobutylamino)ethanol
- IUPAC
- 2-(4-aminobutylamino)ethanol
- English name
- N-(2-Hydroxyethyl)-1,4-butanediamine
- Molecular formula
- C6H16N2O
- Molecular weight
- 132.2
Names & synonyms
23563-86-22-(4-aminobutylamino)ethanol2-((4-Aminobutyl)amino)ethanol2-[(4-AMINOBUTYL)AMINO]ETHAN-1-OL2-((4-aminobutyl)amino)ethan-1-olSCHEMBL974526DTXSID20332254AKOS006329164H85661F447984Ethanol, 2-[(4-aminobutyl)amino]-N-(2-Hydroxyethyl)-1,4-butanediamine
Show more names
N-(2-HYDROXYETHYL)-1,3-BUTANEDIAMINE
Database identifiers
- CAS
23563-86-2- PubChem CID
- 447576
- DTXSID
DTXSID20332254- Nikkaji
- J386.710B
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 58.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 50.3
Physicochemical properties
- Boiling point
- 256 °C · 256°C
- Density
- 0.96 · 0.960
- Flash point
- 109 °C · 109°C
- pka
- 14.797 · 14.797±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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