Perfluoro-6-isopropoxyhexanamide

CAT: 0127-PC6761-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC6761-01Size:1 g

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CAS Number

29952-92-9

Synonyms

Perfluoro-8-methyl-7-oxanonanamide, 6- (Heptafluoroisopropoxy) decafluorohexanamide

MDL Number

MFCD09763610

Purity

=95%

Smiles

NC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)F

Chemical Information

Perfluoro-6-isopropoxyhexanamide

CAS Number	29952-92-9
PubChem CID	45075724
IUPAC Name	2,2,3,3,4,4,5,5,6,6-decafluoro-6-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)hexanamide
Molecular Formula	C9H2F17NO2
Molecular Weight	479.09
XLogP	5
Topological Polar Surface Area	52.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	19
Rotatable Bond Count	7
Heavy Atom Count	29
Formal Charge	0
Complexity	618

SMILES

C(=O)(C(C(C(C(C(OC(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N

InChI

InChI=1S/C9H2F17NO2/c10-2(11,1(27)28)3(12,13)4(14,15)5(16,17)9(25,26)29-6(18,7(19,20)21)8(22,23)24/h(H2,27,28)

InChIKey

QVENIMCKJBZDAX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 29952-92-9

CID: 45075724

Formula: C9H2F17NO2

MW: 479.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	479.09
XLogP3	5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	19
Rotatable Bond Count	7
Exact Mass	478.9814071
Monoisotopic Mass	478.9814071
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	618
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
PC2967-01	Perfluoro-1,6-diiodohexane
PC2253H-01	Perfluoro (1,6-dibromohexane)
PC107893	Ammonium perfluoro-3,6-dioxaoctanoate
PC8092-01	Perfluoro (1-chloro-6-iodohexane)
PC56145	Perfluoro (3,6-dioxaoctanoic acid)
PC1947-01	Methyl perfluoro-3,6-dioxaheptanoate
PC7256	Perfluoro-3,6-dioxadecanoic acid
PC6402-01	Perfluoro-2,6-dimethylheptyl bromide
PC5519-01	Perfluoro-3,6-dioxaheptanoic acid
PC7594	Methyl perfluoro-3,6-dioxadecanoate

Catalog	Name
sc-257789A	Methyl perfluoro-3,6-dioxadecanoate
TRC-P999323-500MG	Perfluoro-3,6-dioxaheptanoic Acid
sc-257986	Perfluoro-3,6-dioxadecanoic acid
sc-263702	Methyl perfluoro-3,6-dioxaheptanoate
FP84485-01	Perfluoro-3,6,9-trioxatridecanoic acid
sc-264018	Perfluoro-3,6,9-trioxadecanoic acid
sc-263703A	Methyl perfluoro-3,6,9-trioxatridecanoate
FP85579-01	Perfluoro-2,3,5,6-tetramethylcyclohexane
FP77727-01	Perfluoro (methyldecalin)
TRC-P999370-1G	Perfluoro(butylcyclohexane)