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13031-44-2 | Methanone, [4-(acetyloxy)phenyl]phenyl-
CAS No: 13031-44-2 Catalog No: AG000UAH MDL No:
Product Description
Catalog Number:
AG000UAH
Chemical Name:
Methanone, [4-(acetyloxy)phenyl]phenyl-
CAS Number:
13031-44-2
Molecular Formula:
C15H12O3
Molecular Weight:
240.2540
IUPAC Name:
(4-benzoylphenyl) acetate
InChI:
InChI=1S/C15H12O3/c1-11(16)18-14-9-7-13(8-10-14)15(17)12-5-3-2-4-6-12/h2-10H,1H3
InChI Key:
DGBLQRCFBNFTSZ-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(cc1)C(=O)c1ccccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.258g/mol
Monoisotopic Mass:
240.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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