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28310 Sigma-Aldrich

2-Cyanoethyl phosphate barium salt dihydrate

≥95.0%

Synonym: Barium 2-cyanoethyl phosphate, Phosphoric acid 2-cyanoethyl ester barium salt

  • CAS Number 5015-38-3

  • Linear Formula NCCH2CH2OPO3Ba · 2H2O

  • Molecular Weight 322.40

  •  Beilstein/REAXYS Number 5662807

  •  EC Number 225-696-5

  •  MDL number MFCD00150047

  •  PubChem Substance ID 57648299

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Properties

Related Categories Building Blocks, Chemical Synthesis, Organic Building Blocks, Organic Phosphates/Phosphites, Phosphorus Compounds More...
Quality Level   200
assay   ≥95.0%
solubility   1 M HCl: soluble 0.25 g/5mL, clear, colorless
SMILES string   O.O.[Ba++].[O-]P([O-])(=O)OCCC#N
InChI   1S/C3H6NO4P.Ba.2H2O/c4-2-1-3-8-9(5,6)7;;;/h1,3H2,(H2,5,6,7);;2*1H2/q;+2;;/p-2
InChI key   SFFRVKYTJRRUNW-UHFFFAOYSA-L

Description

Application

2-Cyanoethyl phosphate barium salt dehydrate has been used in the chemical synthesis of 3′- and 5′-monophosphate derivatives of O6-alkyl-2′-deoxyguanosine.

Packaging

5 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Personal Protective Equipment 
RIDADR 
UN 2811 6.1 / PGIII
WGK Germany 
WGK 1
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles
Peer-Reviewed Papers
15

References

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