Basic information
- CAS
68155-59-9- Standard SMILES
O=P(O)(O)OCCN(CCO)CCOP(=O)(O)O.O=P(O)(O)OCCN(CCO)CCOP(=O)(O)O.O=P(O)(O)OCCN(CCO)CCOP(=O)(O)O.O=P(O)(O)OCCN(CCO)CCOP(=O)(O)O.OCCN(CCO)CCO- InChIKey
IFHJTFVTPPCLSK-UHFFFAOYSA-N- Molecular formula
- C30H83N5O39P8
- Average molar mass
- 1,385.8 g/mol
- Monoisotopic mass
- 1,385.2566138
Names & identifiers
- Preferred name
- Ethanol, 2,2',2''-nitrilotris-, compd. with P,P'-[[(2-hydroxyethyl)imino]di-2,1-ethanediyl] bis(dihydrogen phosphate) (4:1)
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;tetrakis(2-[2-hydroxyethyl(2-phosphonooxyethyl)amino]ethyl dihydrogen phosphate)
Names & synonyms
Triethanolamine, diphosphate ester, tetra(triethanolamine) saltEINECS 268-971-5RefChem:13821568155-59-92,2'-((2-Hydroxyethyl)imino)bisethyl bis(dihydrogen phosphate), compound with 2,2',2''-nitrilotris(ethanol) (1:4)
Database identifiers
- CAS
68155-59-9- PubChem CID
- 109657
- EC Number
- 268-971-5
Properties
Computed structural properties
- Topological polar surface area
- 692 Ų
- Hydrogen bond donors
- 23
- Hydrogen bond acceptors
- 44
- Rotatable bonds
- 46
- Heavy atoms
- 82
- Formal charge
- 0
- Complexity
- 340
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanol, 2,2',2''-nitrilotris-, compd. with P,P'-[[(2-hydroxyethyl)imino]di-2,1-ethanediyl] bis(dihydrogen phosphate) (4:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…