Hexafluoroacetone azine

CAT: 0024-sc-228290Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-228290Size:1 g

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CAS Number

1619-84-7

Chemical Information

Hexafluoroacetone azine

CAS Number	1619-84-7
PubChem CID	5080246
IUPAC Name	1,1,1,3,3,3-hexafluoro-N-(1,1,1,3,3,3-hexafluoropropan-2-ylideneamino)propan-2-imine
Molecular Formula	C6F12N2
Molecular Weight	328.06
XLogP	4.9
Topological Polar Surface Area	24.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	1
Heavy Atom Count	20
Formal Charge	0
Complexity	330

SMILES

C(=NN=C(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C6F12N2/c7-3(8,9)1(4(10,11)12)19-20-2(5(13,14)15)6(16,17)18

InChIKey

SZLJMGDRBNZIIE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1619-84-7

CID: 5080246

Formula: C6F12N2

MW: 328.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	328.06
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	1
Exact Mass	327.9869860
Monoisotopic Mass	327.9869860
Topological Polar Surface Area	24.7 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	330
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-257582A	Hexafluoroacetone sesquihydrate
sc-250103	Hexafluoroacetone trihydrate
sc-257582	Hexafluoroacetone sesquihydrate
sc-353619	Hexafluoroacetone trideuterate D2O
sc-280078	Salicylaldehyde azine
sc-278670	Acetophenone azine
sc-216051	Vanillin azine
sc-278727	Benzaldehyde azine
sc-233803	Acetone azine
sc-280078A	Salicylaldehyde azine

Catalog	Name
PC1026367	Hexafluoroacetone azine
451840-01	Hexafluoroacetone
451841-01	Hexafluoroacetone sesquihydrate
TRC-H305130-2.5G	Hexafluoroacetone Hydrate
TRC-H294913-500MG	Hexafluoroacetone Trihydrate
DE2206-01	Hexafluoroacetone sesquideuterate
H03645	Hexafluoroacetone 97%
FF67478-01	Flavanone azine
RM-S010300-01	Salicylaldehyde Azine
A04770	Acetophenone Azine