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Home > Fluorides > 101913-87-5
101913-87-5 | 4-Heptanone, 1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, 2,2-dimethylhydrazone
CAS No: 101913-87-5 Catalog No: AG0005XW MDL No:
Product Description
Catalog Number:
AG0005XW
Chemical Name:
4-Heptanone, 1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, 2,2-dimethylhydrazone
CAS Number:
101913-87-5
Molecular Formula:
C11H12F12N2O2
Molecular Weight:
432.2060
IUPAC Name:
4-(dimethylhydrazinylidene)-1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)heptane-2,6-diol
InChI:
InChI=1S/C11H12F12N2O2/c1-25(2)24-5(3-6(26,8(12,13)14)9(15,16)17)4-7(27,10(18,19)20)11(21,22)23/h26-27H,3-4H2,1-2H3
InChI Key:
LFSNEOLCHCTNCL-UHFFFAOYSA-N
SMILES:
CN(N=C(CC(C(F)(F)F)(C(F)(F)F)O)CC(C(F)(F)F)(C(F)(F)F)O)C
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.071g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
16
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
432.21g/mol
Monoisotopic Mass:
432.071g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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