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1682-31-1 | Heptane, 1,1,1,2,2,3,3,4,4,5,5-undecafluoro-7-iodo-
CAS No: 1682-31-1 Catalog No: AG001XWQ MDL No:MFCD18641886
Product Description
Catalog Number:
AG001XWQ
Chemical Name:
Heptane, 1,1,1,2,2,3,3,4,4,5,5-undecafluoro-7-iodo-
CAS Number:
1682-31-1
Molecular Formula:
C7H4F11I
Molecular Weight:
423.9936
MDL Number:
MFCD18641886
IUPAC Name:
1,1,1,2,2,3,3,4,4,5,5-undecafluoro-7-iodoheptane
InChI:
InChI=1S/C7H4F11I/c8-3(9,1-2-19)4(10,11)5(12,13)6(14,15)7(16,17)18/h1-2H2
InChI Key:
KEHJVWWDDAAVHB-UHFFFAOYSA-N
SMILES:
ICCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
EC Number:
216-862-8
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.918g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
423.996g/mol
Monoisotopic Mass:
423.918g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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