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2-Chloro-1,3-bis(dimethylamino) Trimethinium Hexafluorophosphate (HF Salt)

2-Chloro-1,3-bis(dimethylamino) Trimethinium Hexafluorophosphate (HF Salt)

CAS Number: 291756-76-8

Molecular Formula: C7H14ClF6N2P

Purity: 99.55

About the product

2-Chloro-1,3-Bis(Dimethylamino)Trimethinium Hexafluorophosphate is a chemical compound primarily used as an intermediate in the synthesis of pharmaceuticals, notably Etoricoxib, a selective COX-2 inhibitor used to treat pain and inflammation. it has two associated cas numbers: 249561-98-6 and 291756-76-8.

2-Chloro-1,3-bis(dimethylamino) Trimethinium Hexafluorophosphate (HF Salt) Specifications

CAS Number

291756-76-8

Molecular Formula

C7H14ClF6N2P

IUPAC Name

[(Z)-2-chloro-3-(dimethylamino)prop-2-enylidene]-dimethylazanium;hexafluorophosphate

Canonical SMILES

CN(C)/C=C(/C=[N+](C)C)\Cl.F[P-](F)(F)(F)(F)F

InChI Key

PIUHAULDXSPPQV-UHFFFAOYSA-N

InChI

1S/C7H14ClN2.F6P/c1-9(2)5-7(8)6-10(3)4;1-7(2,3,4,5)6/h5-6H,1-4H3;/q+1;-1

PubChem CID

10590807

MDL Number

MFCD08458255

UNSPSC Code

12181600

eClass

32039000

NACRES

NA.22

HSN No

2933.39.90

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