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89608-31-1 | 3-Hepten-1-ol, 5,5,6,6,7,7,7-heptafluoro-3-iodo-
CAS No: 89608-31-1 Catalog No: AG003YQH MDL No:
Product Description
Catalog Number:
AG003YQH
Chemical Name:
3-Hepten-1-ol, 5,5,6,6,7,7,7-heptafluoro-3-iodo-
CAS Number:
89608-31-1
Molecular Formula:
C7H6F7IO
Molecular Weight:
366.0152
IUPAC Name:
5,5,6,6,7,7,7-heptafluoro-3-iodohept-3-en-1-ol
InChI:
InChI=1S/C7H6F7IO/c8-5(9,3-4(15)1-2-16)6(10,11)7(12,13)14/h3,16H,1-2H2
InChI Key:
SWQYQRRRCMRVRW-UHFFFAOYSA-N
SMILES:
OCCC(=CC(C(C(F)(F)F)(F)F)(F)F)I
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.935g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.017g/mol
Monoisotopic Mass:
365.935g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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