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89807-89-6 | 2-Octanol, 1-ethoxy-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-
CAS No: 89807-89-6 Catalog No: AG003Y6I MDL No:
Product Description
Catalog Number:
AG003Y6I
Chemical Name:
2-Octanol, 1-ethoxy-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-
CAS Number:
89807-89-6
Molecular Formula:
C10H9F13O2
Molecular Weight:
408.1565
IUPAC Name:
1-ethoxy-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-2-ol
InChI:
InChI=1S/C10H9F13O2/c1-2-25-3-4(24)5(11,12)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)23/h4,24H,2-3H2,1H3
InChI Key:
FOLLFKFJTLMQFL-UHFFFAOYSA-N
SMILES:
CCOCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.039g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
15
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
408.159g/mol
Monoisotopic Mass:
408.039g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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