Calcium phosphorylcholine chloride

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Catalog Number
ACM4826715
Product Name
Calcium phosphorylcholine chloride
Structure
Structure
CAS
4826-71-5
Category
Main Products
Synonyms
Choline phosphate chloride
IUPAC Name
Calcium;2-(trimethylazaniumyl)ethyl phosphate;chloride
Molecular Weight
206.13
Molecular Formula
C3H4KO6P
Canonical SMILES
C[N+](C)(C)CCOP(=O)([O-])[O-].[Cl-].[Ca+2]
InChI
InChI=1S/C5H14NO4P.Ca.ClH/c1-6(2,3)4-5-10-11(7,8)9;;/h4-5H2,1-3H3,(H-,7,8,9);;1H/q;+2;/p-2
InChI Key
ICVPTJCCKTXCDT-UHFFFAOYSA-L
Melting Point
175 °C(lit.)
Appearance
Solid
Storage
2-8 °C
Complexity
147
Exact Mass
256.9896634
Hazard Statements
Xi
Monoisotopic Mass
256.9896634
Safety Description
26-36
Topological Polar Surface Area
72.4 Ų
WGK Germany
3
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