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155401-47-1 | Heptadecane, 17-bromo-1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-
CAS No: 155401-47-1 Catalog No: AG001NVL MDL No:
Product Description
Catalog Number:
AG001NVL
Chemical Name:
Heptadecane, 17-bromo-1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-
CAS Number:
155401-47-1
Molecular Formula:
C17H22BrF13
Molecular Weight:
553.2398
IUPAC Name:
17-bromo-1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoroheptadecane
InChI:
InChI=1S/C17H22BrF13/c18-11-9-7-5-3-1-2-4-6-8-10-12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)31/h1-11H2
InChI Key:
LDUXQPXCIDUCDA-UHFFFAOYSA-N
SMILES:
BrCCCCCCCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
552.07g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
553.246g/mol
Monoisotopic Mass:
552.07g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
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