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Home > Fluorides > 114589-63-8
114589-63-8 | 2-Propenoic acid, 2-fluoro-, 2,3,4,5,6-pentafluorophenyl ester
CAS No: 114589-63-8 Catalog No: AG000EQY MDL No:
Product Description
Catalog Number:
AG000EQY
Chemical Name:
2-Propenoic acid, 2-fluoro-, 2,3,4,5,6-pentafluorophenyl ester
CAS Number:
114589-63-8
Molecular Formula:
C9H2F6O2
Molecular Weight:
256.1014
IUPAC Name:
(2,3,4,5,6-pentafluorophenyl) 2-fluoroprop-2-enoate
InChI:
InChI=1S/C9H2F6O2/c1-2(10)9(16)17-8-6(14)4(12)3(11)5(13)7(8)15/h1H2
InChI Key:
BMCZFRLMABFVMN-UHFFFAOYSA-N
SMILES:
FC(=C)C(=O)Oc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.996g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.103g/mol
Monoisotopic Mass:
255.996g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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