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1017781-67-7 | Ethanone, 1-[3-(aminomethyl)phenyl]-2-phenyl-
CAS No: 1017781-67-7 Catalog No: AG0005IW MDL No:MFCD09997765
Product Description
Catalog Number:
AG0005IW
Chemical Name:
Ethanone, 1-[3-(aminomethyl)phenyl]-2-phenyl-
CAS Number:
1017781-67-7
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
MDL Number:
MFCD09997765
IUPAC Name:
1-[3-(aminomethyl)phenyl]-2-phenylethanone
InChI:
InChI=1S/C15H15NO/c16-11-13-7-4-8-14(9-13)15(17)10-12-5-2-1-3-6-12/h1-9H,10-11,16H2
InChI Key:
UQQRLURZYOPSCJ-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)C(=O)Cc1ccccc1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.291g/mol
Monoisotopic Mass:
225.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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