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138716-22-0 | 2-Propen-1-one, 1-[1,1'-biphenyl]-4-yl-3-(dimethylamino)-
CAS No: 138716-22-0 Catalog No: AG001928 MDL No:MFCD00172114
Product Description
Catalog Number:
AG001928
Chemical Name:
2-Propen-1-one, 1-[1,1'-biphenyl]-4-yl-3-(dimethylamino)-
CAS Number:
138716-22-0
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
MDL Number:
MFCD00172114
IUPAC Name:
3-(dimethylamino)-1-(4-phenylphenyl)prop-2-en-1-one
InChI:
InChI=1S/C17H17NO/c1-18(2)13-12-17(19)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-13H,1-2H3
InChI Key:
VOZCAYLHVNCRJS-UHFFFAOYSA-N
SMILES:
CN(C=CC(=O)c1ccc(cc1)c1ccccc1)C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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