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89004-77-3

89004-77-3 | 2-Propenoic acid, 2-methyl-, undecafluoropentyl ester

CAS No: 89004-77-3 Catalog No: AG004621 MDL No:

Product Description

Catalog Number:
AG004621
Chemical Name:
2-Propenoic acid, 2-methyl-, undecafluoropentyl ester
CAS Number:
89004-77-3
Molecular Formula:
C9H5F11O2
Molecular Weight:
354.1172
IUPAC Name:
1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl 2-methylprop-2-enoate
InChI:
InChI=1S/C9H5F11O2/c1-3(2)4(21)22-9(19,20)7(14,15)5(10,11)6(12,13)8(16,17)18/h1H2,2H3
InChI Key:
BWIUYRXKEFSAJX-UHFFFAOYSA-N
SMILES:
O=C(C(=C)C)OC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F

Properties

Complexity:
463  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.011g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.119g/mol
Monoisotopic Mass:
354.011g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  

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