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727-55-9 | 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrafluoro-, dimethyl ester
CAS No: 727-55-9 Catalog No: AG005FH7 MDL No:MFCD25966677
Product Description
Catalog Number:
AG005FH7
Chemical Name:
1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrafluoro-, dimethyl ester
CAS Number:
727-55-9
Molecular Formula:
C10H6F4O4
Molecular Weight:
266.1459
MDL Number:
MFCD25966677
IUPAC Name:
dimethyl 2,3,5,6-tetrafluorobenzene-1,4-dicarboxylate
InChI:
InChI=1S/C10H6F4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3
InChI Key:
JCEMPCVTIITKAC-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(F)c(F)c(c(c1F)F)C(=O)OC
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.02g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.148g/mol
Monoisotopic Mass:
266.02g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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