Einecs 300-993-3
Basic information
- CAS
88394-55-2- Standard SMILES
CC(O)(P(=O)(O)O)P(=O)(O)O.OCCNCCO- InChIKey
WUKJKYZVFWHKSC-UHFFFAOYSA-N- Molecular formula
- C6H19NO9P2
- Average molar mass
- 311.16 g/mol
- Monoisotopic mass
- 311.05350518
Names & identifiers
- Preferred name
- Einecs 300-993-3
- IUPAC
- 2-(2-hydroxyethylamino)ethanol;(1-hydroxy-1-phosphonoethyl)phosphonic acid
Names & synonyms
93966-42-8EINECS 300-993-3Etidronate diethanolamineSCHEMBL9164232DTXSID60916810WUKJKYZVFWHKSC-UHFFFAOYSA-NL3LY5M2538(1-Hydroxyethylidene)bisphosphonic acid, compound with 2,2'-iminobis(ethanol) (1:1)(1-Hydroxyethane-1,1-diyl)bis(phosphonic acid)--2,2'-azanediyldi(ethan-1-ol) (1/1)Ethanol, 2,2'-iminobis-, (1-hydroxyethylidene)bis[phosphonate] (1:1) (salt)
Database identifiers
- CAS
88394-55-2、93966-42-8- PubChem CID
- 44153266
- DTXSID
DTXSID60916810- UNII
- L3LY5M2538
- EC Number
- 300-993-3
Properties
Computed structural properties
- Topological polar surface area
- 188 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 240
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Related reactions
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Compound notes
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