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81593-08-0 | Benzamide, N-9-phenanthrenyl-
CAS No: 81593-08-0 Catalog No: AG0058EA MDL No:
Product Description
Catalog Number:
AG0058EA
Chemical Name:
Benzamide, N-9-phenanthrenyl-
CAS Number:
81593-08-0
Molecular Formula:
C21H15NO
Molecular Weight:
297.3499
IUPAC Name:
N-phenanthren-9-ylbenzamide
InChI:
InChI=1S/C21H15NO/c23-21(15-8-2-1-3-9-15)22-20-14-16-10-4-5-11-17(16)18-12-6-7-13-19(18)20/h1-14H,(H,22,23)
InChI Key:
RBNQVKMQUSUUSY-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Nc1cc2ccccc2c2c1cccc2
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.115g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.357g/mol
Monoisotopic Mass:
297.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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