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20687-94-9 | Isobenzofuran, 4,5,6,7-tetrachloro-1,1,3,3-tetrafluoro-1,3-dihydro-
CAS No: 20687-94-9 Catalog No: AG002IQJ MDL No:
Product Description
Catalog Number:
AG002IQJ
Chemical Name:
Isobenzofuran, 4,5,6,7-tetrachloro-1,1,3,3-tetrafluoro-1,3-dihydro-
CAS Number:
20687-94-9
Molecular Formula:
C8Cl4F4O
Molecular Weight:
329.8906
IUPAC Name:
4,5,6,7-tetrachloro-1,1,3,3-tetrafluoro-2-benzofuran
InChI:
InChI=1S/C8Cl4F4O/c9-3-1-2(4(10)6(12)5(3)11)8(15,16)17-7(1,13)14
InChI Key:
PPBOBVMQIXWDTC-UHFFFAOYSA-N
SMILES:
Clc1c(Cl)c(Cl)c(c2c1C(F)(F)OC2(F)F)Cl
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.861g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.881g/mol
Monoisotopic Mass:
327.864g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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