Basic information
- CAS
37107-08-7- Standard SMILES
O=[P+](O)OCN(CCN(CO[P+](=O)O)CO[P+](=O)O)CCN(CO[P+](=O)O)CO[P+](=O)O- InChIKey
PBHXLXJLHCENHW-UHFFFAOYSA-S- Molecular formula
- C9H23N3O15P5+5
- Average molar mass
- 568.16 g/mol
- Monoisotopic mass
- 567.98172702
Names & identifiers
- Preferred name
- Diethylenetriaminopentamethylphosphonic acid
- IUPAC
- [bis[2-[bis[[hydroxy(oxo)phosphaniumyl]oxymethyl]amino]ethyl]amino]methoxy-hydroxy-oxophosphanium
- English name
- Phosphonic acid, ((((hydroxyphosphinyl)oxy)methyl)imino)bis((2,1-ethan ediylnitrilo)bis(methylene)) ester
- Molecular formula
- C9H28N3O15P5
- Molecular weight
- 573.2
Names & synonyms
Diethylenetriaminopentamethylphosphonic acidDTPP37107-08-7Phosphonic acid, ((((hydroxyphosphinyl)oxy)methyl)imino)bis((2,1-ethanediylnitrilo)bis(methylene)) ester[bis[2-[bis[[hydroxy(oxo)phosphaniumyl]oxymethyl]amino]ethyl]amino]methoxy-hydroxy-oxophosphaniumSCHEMBL29412564Phosphonic acid, ((((hydroxyphosphinyl)oxy)methyl)imino)bis((2,1-ethan ediylnitrilo)bis(methylene)) esterPhosphonic acid, [[[(hydroxyphosphinyl)oxy]methyl]imino]bis[(2,1-ethanediylnitrilo)bis(methylene)] ester (9CI)
Database identifiers
- CAS
37107-08-7- PubChem CID
- 6367229
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 242 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 21
- Heavy atoms
- 32
- Formal charge
- 5
- Complexity
- 564
Physicochemical properties
- Boiling point
- 780.9 · 780.9±70.0 °C(Predicted)
- pka
- 4.09 · 4.09±0.50(Predicted)
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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