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114292-89-6

114292-89-6 | Octanol, heptadecafluoro- (9CI)

CAS No: 114292-89-6 Catalog No: AG000B0D MDL No:

Product Description

Catalog Number:
AG000B0D
Chemical Name:
Octanol, heptadecafluoro- (9CI)
CAS Number:
114292-89-6
Molecular Formula:
C8HF17O
Molecular Weight:
436.0658
IUPAC Name:
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctan-1-ol
InChI:
InChI=1S/C8HF17O/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)26/h26H
InChI Key:
UQDUPHDELLQMOV-UHFFFAOYSA-N
SMILES:
OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Properties

Complexity:
527  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
435.976g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
18  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
436.068g/mol
Monoisotopic Mass:
435.976g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4  

Literature

Title Journal
Sonic spray as a dual polarity ion source for ion/ion reactions. Analytical chemistry 20050601

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