AG002HD7

188826-61-1 | N-[3-(Dimethylamino)allylidene]-N-methylmethanaminium Hexafluorophosphate

AG002HD7

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CAS Number	188826-61-1
Catalog Number	AG002HD7(AGN-PC-0NE7LY)
Chemical Name	N-[3-(Dimethylamino)allylidene]-N-methylmethanaminium Hexafluorophosphate
IUPAC Name	[(E)-3-(dimethylamino)prop-2-enylidene]-dimethylazanium;hexafluorophosphate
InChI	InChI=1S/C7H15N2.F6P/c1-8(2)6-5-7-9(3)4;1-7(2,3,4,5)6/h5-7H,1-4H3;/q+1;-1
InChI Key	OXNPJRWNJQGZRQ-UHFFFAOYSA-N
MDL Number	MFCD09788576
Molecular Formula	C7H15F6N2P
Molecular Weight	272.1716
SMILES	C[N+](C)=C/C=C/N(C)C.F[P-](F)(F)(F)(F)F
Synonyms	188826-61-1, N-[3-(Dimethylamino)allylidene]-N-methylmethanaminium Hexafluorophosphate, (E)-N-(3-(DIMETHYLAMINO)ALLYLIDENE)-N-METHYLMETHANAMINIUM HEXAFLUOROPHOSPHATE, (3-dimethylaminoallylidene)dimethylammonium hexafluorophosphate, C7H15N2.F6P, 7207AJ, MFCD09788576, AB52496, CM11012, SC-91287, [(E)-3-(dimethylamino)prop-2-enylidene]-dimethylaz, 1,3-BIS(DIMETHYLAMINO)TRIMETHINIUM HEXAFLUOROPHOSPHATE, Methanaminium, N-[3-(dimethylamino)-2-propenylidene]-N-methyl-,hexafluorophosphate(1-), Methanaminium, N-[3-(dimethylamino)-2-propen-1-ylidene]-N-methyl-, hexafluorophosphate(1-) (1:1), CID11000188, CID 11000188,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	272.088g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	272.175g/mol
Monoisotopic Mass	272.088g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	6.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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