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71356-37-1 | Decanoic acid, nonadecafluoro-, 1-methylethyl ester
CAS No: 71356-37-1 Catalog No: AG005IZD MDL No:
Product Description
Catalog Number:
AG005IZD
Chemical Name:
Decanoic acid, nonadecafluoro-, 1-methylethyl ester
CAS Number:
71356-37-1
Molecular Formula:
C13H7F19O2
Molecular Weight:
556.1631
IUPAC Name:
propan-2-yl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecanoate
InChI:
InChI=1S/C13H7F19O2/c1-3(2)34-4(33)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)12(28,29)13(30,31)32/h3H,1-2H3
InChI Key:
PUQVAEZFKDVVJR-UHFFFAOYSA-N
SMILES:
CC(OC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C
Properties
Complexity:
763
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.014g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
21
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
556.167g/mol
Monoisotopic Mass:
556.014g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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