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72370-89-9 | Cyclobutanecarboxylic acid, 1-(4-ethoxyphenyl)-2,2,3,3-tetrafluoro-, (R)-
CAS No: 72370-89-9 Catalog No: AG005HZJ MDL No:
Product Description
Catalog Number:
AG005HZJ
Chemical Name:
Cyclobutanecarboxylic acid, 1-(4-ethoxyphenyl)-2,2,3,3-tetrafluoro-, (R)-
CAS Number:
72370-89-9
Molecular Formula:
C13H12F4O3
Molecular Weight:
292.2262
IUPAC Name:
(1R)-1-(4-ethoxyphenyl)-2,2,3,3-tetrafluorocyclobutane-1-carboxylic acid
InChI:
InChI=1S/C13H12F4O3/c1-2-20-9-5-3-8(4-6-9)11(10(18)19)7-12(14,15)13(11,16)17/h3-6H,2,7H2,1H3,(H,18,19)/t11-/m1/s1
InChI Key:
GIODGGUATRIZGS-LLVKDONJSA-N
SMILES:
CCOc1ccc(cc1)[C@]1(CC(C1(F)F)(F)F)C(=O)O
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
292.072g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.23g/mol
Monoisotopic Mass:
292.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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