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144295-00-1 | 3-Octen-2-ol, 5,5,6,6,7,7,8,8,8-nonafluoro-3-iodo-2-methyl-
CAS No: 144295-00-1 Catalog No: AG001J9K MDL No:
Product Description
Catalog Number:
AG001J9K
Chemical Name:
3-Octen-2-ol, 5,5,6,6,7,7,8,8,8-nonafluoro-3-iodo-2-methyl-
CAS Number:
144295-00-1
Molecular Formula:
C9H8F9IO
Molecular Weight:
430.0493
IUPAC Name:
5,5,6,6,7,7,8,8,8-nonafluoro-3-iodo-2-methyloct-3-en-2-ol
InChI:
InChI=1S/C9H8F9IO/c1-5(2,20)4(19)3-6(10,11)7(12,13)8(14,15)9(16,17)18/h3,20H,1-2H3
InChI Key:
RQUUNYKQJTVEJD-UHFFFAOYSA-N
SMILES:
IC(=CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(O)(C)C
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
429.948g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
430.052g/mol
Monoisotopic Mass:
429.948g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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