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1260817-78-4 | Ethyl (3-methyl-4-phenylbenzoyl)acetate
CAS No: 1260817-78-4 Catalog No: AG01FC9J MDL No:
Product Description
Catalog Number:
AG01FC9J
Chemical Name:
Ethyl (3-methyl-4-phenylbenzoyl)acetate
CAS Number:
1260817-78-4
Molecular Formula:
C18H18O3
Molecular Weight:
282.3337
IUPAC Name:
ethyl 3-(3-methyl-4-phenylphenyl)-3-oxopropanoate
InChI:
InChI=1S/C18H18O3/c1-3-21-18(20)12-17(19)15-9-10-16(13(2)11-15)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3
InChI Key:
UVBPFXNRMVSGPA-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1ccc(c(c1)C)c1ccccc1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.339g/mol
Monoisotopic Mass:
282.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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