Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
Basic information
- CAS
60789-80-2- Standard SMILES
CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.O=C(O)CC(O)(CC(=O)O)C(=O)O- InChIKey
WORLLILUGHBXRR-UHFFFAOYSA-N- Molecular formula
- C24H53N3O7
- Average molar mass
- 495.7 g/mol
- Monoisotopic mass
- 495.38835104
Names & identifiers
- Preferred name
- Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
- IUPAC
- tris(N,N-diethylethanamine);2-hydroxypropane-1,2,3-tricarboxylic acid
Names & synonyms
60789-80-2SCHEMBL2064710DTXSID10976262Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)2-Hydroxypropane-1,2,3-tricarboxylic acid--N,N-diethylethanamine (1/3)
Database identifiers
- CAS
60789-80-2- PubChem CID
- 62167
- DTXSID
DTXSID10976262
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 253
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…