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88815-27-4 | Benzoic acid, 2-(benzoyloxy)-, phenyl ester
CAS No: 88815-27-4 Catalog No: AG004AS0 MDL No:
Product Description
Catalog Number:
AG004AS0
Chemical Name:
Benzoic acid, 2-(benzoyloxy)-, phenyl ester
CAS Number:
88815-27-4
Molecular Formula:
C20H14O4
Molecular Weight:
318.3228
IUPAC Name:
phenyl 2-benzoyloxybenzoate
InChI:
InChI=1S/C20H14O4/c21-19(15-9-3-1-4-10-15)24-18-14-8-7-13-17(18)20(22)23-16-11-5-2-6-12-16/h1-14H
InChI Key:
LIDDQKAMUXHIQD-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Oc1ccccc1C(=O)Oc1ccccc1
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.089g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.328g/mol
Monoisotopic Mass:
318.089g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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