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89697-37-0 | Ethanone, 2-(dimethoxyphenyl)-1-phenyl-
CAS No: 89697-37-0 Catalog No: AG0044AM MDL No:
Product Description
Catalog Number:
AG0044AM
Chemical Name:
Ethanone, 2-(dimethoxyphenyl)-1-phenyl-
CAS Number:
89697-37-0
Molecular Formula:
C16H16O3
Molecular Weight:
256.2964
IUPAC Name:
2-(2,3-dimethoxyphenyl)-1-phenylethanone
InChI:
InChI=1S/C16H16O3/c1-18-15-10-6-9-13(16(15)19-2)11-14(17)12-7-4-3-5-8-12/h3-10H,11H2,1-2H3
InChI Key:
NWXHSHOKEQZAGJ-UHFFFAOYSA-N
SMILES:
COc1c(cccc1OC)CC(=O)c1ccccc1
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.301g/mol
Monoisotopic Mass:
256.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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