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78634-33-0 | Benz[f]isoquinolin-2(1H)-one, 3,4-dihydro-4-phenyl-
CAS No: 78634-33-0 Catalog No: AG008M86 MDL No:
Product Description
Catalog Number:
AG008M86
Chemical Name:
Benz[f]isoquinolin-2(1H)-one, 3,4-dihydro-4-phenyl-
CAS Number:
78634-33-0
Molecular Formula:
C19H15NO
Molecular Weight:
273.3285
IUPAC Name:
4-phenyl-3,4-dihydro-1H-benzo[f]isoquinolin-2-one
InChI:
InChI=1S/C19H15NO/c21-18-12-17-15-9-5-4-6-13(15)10-11-16(17)19(20-18)14-7-2-1-3-8-14/h1-11,19H,12H2,(H,20,21)
InChI Key:
NEIHVSRZUUUHCM-UHFFFAOYSA-N
SMILES:
O=C1NC(c2ccccc2)c2c(C1)c1ccccc1cc2
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.115g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.335g/mol
Monoisotopic Mass:
273.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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