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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
calcium tetrahydrate chloride [2-(trimethylazaniumyl)ethyl] phosphate

Inventory

CAS number:
72556-74-2
Synonyms
Names:
Identifier:
common name
Trimethyl-2-(phosphonooxy)ethanaminium chloride calcium salt (1:1) tetrahydrate
Identifier:
common name
phosphorylcholine chloride calcium salt tetrahydrate

Molecular and structural information

Molecular formula:
C5H21CaClNO8P
Molecular weight:
329.727
SMILES notation:
[Ca+2].[Cl-].O.O.O.O.[O-]P([O-])(=O)OCC[N+](C)(C)C
InChl:
InChI=1S/C5H14NO4P.Ca.ClH.4H2O/c1-6(2,3)4-5-10-11(7,8)9;;;;;;/h4-5H2,1-3H3,(H-,7,8,9);;1H;4*1H2/q;+2;;;;;/p-2
Structural formula:
Chemical structure

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