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54916-28-8 | 1-(4-(4-Methoxyphenoxy)phenyl)ethanone
CAS No: 54916-28-8 Catalog No: AG003KMJ MDL No:MFCD00052928
Product Description
Catalog Number:
AG003KMJ
Chemical Name:
1-(4-(4-Methoxyphenoxy)phenyl)ethanone
CAS Number:
54916-28-8
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
MDL Number:
MFCD00052928
IUPAC Name:
1-[4-(4-methoxyphenoxy)phenyl]ethanone
InChI:
InChI=1S/C15H14O3/c1-11(16)12-3-5-14(6-4-12)18-15-9-7-13(17-2)8-10-15/h3-10H,1-2H3
InChI Key:
ICXPZMQQZWKKMN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Oc1ccc(cc1)C(=O)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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