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Home > Fluorides > 116486-78-3
116486-78-3 | 1-Decanol, 7,7,8,8,9,9,10,10,10-nonafluoro-5-iodo-
CAS No: 116486-78-3 Catalog No: AG000CLY MDL No:
Product Description
Catalog Number:
AG000CLY
Chemical Name:
1-Decanol, 7,7,8,8,9,9,10,10,10-nonafluoro-5-iodo-
CAS Number:
116486-78-3
Molecular Formula:
C10H12F9IO
Molecular Weight:
446.0918
IUPAC Name:
7,7,8,8,9,9,10,10,10-nonafluoro-5-iododecan-1-ol
InChI:
InChI=1S/C10H12F9IO/c11-7(12,5-6(20)3-1-2-4-21)8(13,14)9(15,16)10(17,18)19/h6,21H,1-5H2
InChI Key:
WAKUXSKQHJFZNX-UHFFFAOYSA-N
SMILES:
OCCCCC(CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)I
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.979g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
446.095g/mol
Monoisotopic Mass:
445.979g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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