Basic information
- CAS
74698-80-9- Standard SMILES
CC(C)OCC(O)CNCCN- InChIKey
KJPUNPWQEHPNGQ-UHFFFAOYSA-N- Molecular formula
- C8H20N2O2
- Average molar mass
- 176.26 g/mol
- Monoisotopic mass
- 176.15247789
Names & identifiers
- Preferred name
- 1-[(2-Aminoethyl)amino]-3-[(propan-2-yl)oxy]propan-2-ol
- IUPAC
- 1-(2-aminoethylamino)-3-propan-2-yloxypropan-2-ol
Names & synonyms
74698-80-9NSC44074SCHEMBL11231657DTXSID002861801-[(2-Aminoethyl)amino]-3-[(propan-2-yl)oxy]propan-2-olNSC-44074AKOS011422964
Database identifiers
- CAS
74698-80-9- PubChem CID
- 239205
- DTXSID
DTXSID00286180
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 99.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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