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88317-80-0 | Ethanone, 1-[2-[(dimethylamino)methyl]-4,5-dimethoxyphenyl]-2-phenyl-
CAS No: 88317-80-0 Catalog No: AG0048GU MDL No:
Product Description
Catalog Number:
AG0048GU
Chemical Name:
Ethanone, 1-[2-[(dimethylamino)methyl]-4,5-dimethoxyphenyl]-2-phenyl-
CAS Number:
88317-80-0
Molecular Formula:
C19H23NO3
Molecular Weight:
313.3908
IUPAC Name:
1-[2-[(dimethylamino)methyl]-4,5-dimethoxyphenyl]-2-phenylethanone
InChI:
InChI=1S/C19H23NO3/c1-20(2)13-15-11-18(22-3)19(23-4)12-16(15)17(21)10-14-8-6-5-7-9-14/h5-9,11-12H,10,13H2,1-4H3
InChI Key:
ZTMLRNMXBSODNO-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)Cc2ccccc2)c(cc1OC)CN(C)C
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.397g/mol
Monoisotopic Mass:
313.168g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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