(Nitrilotris(methylene))trisphosphonic acid, compound with 2,2',2''-nitrilotris(ethanol)
Basic information
- CAS
14260-80-1- Standard SMILES
O=P(O)(O)CN(CP(=O)(O)O)CP(=O)(O)O.OCCN(CCO)CCO- InChIKey
SZGXNIHLDNALFS-UHFFFAOYSA-N- Molecular formula
- C9H27N2O12P3
- Average molar mass
- 448.24 g/mol
- Monoisotopic mass
- 448.07768529
Names & identifiers
- Preferred name
- (Nitrilotris(methylene))trisphosphonic acid, compound with 2,2',2''-nitrilotris(ethanol)
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;[bis(phosphonomethyl)amino]methylphosphonic acid
Names & synonyms
EINECS 276-623-9DTXSID80103327214260-80-172379-89-6(Nitrilotris(methylene))trisphosphonic acid, compound with 2,2',2''-nitrilotris(ethanol)[nitrilotris(methylene)]trisphosphonic acid, compound with 2,2',2''-nitrilotris[ethanol]RefChem:406704DTXCID50145177DTXSID20222686276-623-9SZGXNIHLDNALFS-UHFFFAOYSA-NPhosphonic acid, P,Pa(2),Pa(2)a(2)-[nitrilotris(methylene)]tris-, compd. with 2,2a(2),2a(2)a(2)-nitrilotris[ethanol] (1:1)
Database identifiers
- CAS
14260-80-1、72379-89-6- PubChem CID
- 44147653
- DTXSID
DTXSID801033272- EC Number
- 276-623-9
Properties
Computed structural properties
- Topological polar surface area
- 240 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 12
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 361
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphonic acid, P,P',P''-[nitrilotris(methylene)]tris-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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