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10293-89-7

10293-89-7 | 1-Propanone,3-(1-isoquinolinyl)-1-phenyl-

CAS No: 10293-89-7 Catalog No: AG00866V MDL No:

Product Description

Catalog Number:
AG00866V
Chemical Name:
1-Propanone,3-(1-isoquinolinyl)-1-phenyl-
CAS Number:
10293-89-7
Molecular Formula:
C18H15NO
Molecular Weight:
261.3178
IUPAC Name:
3-isoquinolin-1-yl-1-phenylpropan-1-one
InChI:
InChI=1S/C18H15NO/c20-18(15-7-2-1-3-8-15)11-10-17-16-9-5-4-6-14(16)12-13-19-17/h1-9,12-13H,10-11H2
InChI Key:
JDMABHCRUHJPLG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CCc1nccc2c1cccc2
NSC Number:
101034

Properties

Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.115g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.324g/mol
Monoisotopic Mass:
261.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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