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Home > Fluorides > 102187-17-7
102187-17-7 | Benzoic acid, 4-hydroxy-, 4-fluorophenyl ester
CAS No: 102187-17-7 Catalog No: AG0006UR MDL No:
Product Description
Catalog Number:
AG0006UR
Chemical Name:
Benzoic acid, 4-hydroxy-, 4-fluorophenyl ester
CAS Number:
102187-17-7
Molecular Formula:
C13H9FO3
Molecular Weight:
232.2072
IUPAC Name:
(4-fluorophenyl) 4-hydroxybenzoate
InChI:
InChI=1S/C13H9FO3/c14-10-3-7-12(8-4-10)17-13(16)9-1-5-11(15)6-2-9/h1-8,15H
InChI Key:
SORDQILSXXTMQP-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(=O)Oc1ccc(cc1)F
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.054g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.21g/mol
Monoisotopic Mass:
232.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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