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178860-08-7 | Methanone, [4-(acetyloxy)phenyl](4-ethylphenyl)-
CAS No: 178860-08-7 Catalog No: AG0026F8 MDL No:
Product Description
Catalog Number:
AG0026F8
Chemical Name:
Methanone, [4-(acetyloxy)phenyl](4-ethylphenyl)-
CAS Number:
178860-08-7
Molecular Formula:
C17H16O3
Molecular Weight:
268.3071
IUPAC Name:
[4-(4-ethylbenzoyl)phenyl] acetate
InChI:
InChI=1S/C17H16O3/c1-3-13-4-6-14(7-5-13)17(19)15-8-10-16(11-9-15)20-12(2)18/h4-11H,3H2,1-2H3
InChI Key:
LLRBDCYBJNSBOI-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)C(=O)c1ccc(cc1)OC(=O)C
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.312g/mol
Monoisotopic Mass:
268.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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