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188838-46-2 | 5-Octen-4-one, 6-amino-1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-
CAS No: 188838-46-2 Catalog No: AG002HE2 MDL No:
Product Description
Catalog Number:
AG002HE2
Chemical Name:
5-Octen-4-one, 6-amino-1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-
CAS Number:
188838-46-2
Molecular Formula:
C10H12F7NO
Molecular Weight:
295.1972
IUPAC Name:
6-amino-1,1,1,2,2,3,3-heptafluoro-7,7-dimethyloct-5-en-4-one
InChI:
InChI=1S/C10H12F7NO/c1-7(2,3)5(18)4-6(19)8(11,12)9(13,14)10(15,16)17/h4H,18H2,1-3H3
InChI Key:
TXUFJTGLMQILHR-UHFFFAOYSA-N
SMILES:
O=C(C(C(C(F)(F)F)(F)F)(F)F)C=C(C(C)(C)C)N
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.081g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.201g/mol
Monoisotopic Mass:
295.081g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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