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1260897-50-4 | Ethyl (2-phenylbenzoyl)acetate
CAS No: 1260897-50-4 Catalog No: AG01FF0L MDL No:
Product Description
Catalog Number:
AG01FF0L
Chemical Name:
Ethyl (2-phenylbenzoyl)acetate
CAS Number:
1260897-50-4
Molecular Formula:
C17H16O3
Molecular Weight:
268.3071
IUPAC Name:
ethyl 3-oxo-3-(2-phenylphenyl)propanoate
InChI:
InChI=1S/C17H16O3/c1-2-20-17(19)12-16(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3
InChI Key:
ICVPIMBNKIXKHI-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1ccccc1c1ccccc1
Properties
Complexity:
331
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:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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