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2-Chloro-1,3-bis(dimethylamino)trimethinium hexafluorophosphate

CAS
291756-76-8
Catalog Number
ACM291756768
Category
Amines
Molecular Weight
306.62
Molecular Formula
C7H14ClF6N2P

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Specification

Synonyms
2-CHLORO-1,3-DIMETHYLAMINO TRIMETHINIUM HEXAFLUOROPHOSPHATE
Hazard Statements
H302 + H312 + H332-H315-H319-H335-H373
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of the compound?

The molecular formula is C7H14ClF6N2P.

What is the molecular weight of the compound?

The molecular weight is 306.62 g/mol.

What are the synonyms of the compound?

The synonyms include 249561-98-6, 291756-76-8, N-(2-Chloro-3-(dimethylamino)allylidene)-N-methylmethanaminium hexafluorophosphate(V), and 2-Chloro-1,3-bis(dimentylamino)trimethinium hexafluorophosphate.

What is the IUPAC name of the compound?

The IUPAC name is [(Z)-2-chloro-3-(dimethylamino)prop-2-enylidene]-dimethylazanium;hexafluorophosphate.

What is the InChI of the compound?

The InChI is 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.

What is the InChIKey of the compound?

The InChIKey is PIUHAULDXSPPQV-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CN(C)C=C(C=[N+](C)C)Cl.F[P-](F)(F)(F)(F)F.

What is the CAS number of the compound?

The CAS number is 249561-98-6.

What is the hydrogen bond donor count of the compound?

The hydrogen bond donor count is 0.

What is the hydrogen bond acceptor count of the compound?

The hydrogen bond acceptor count is 8.

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