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Home Other Building Blocks 3(2H)-Isoquinolinone, 1,4-dihydro-1-phenyl-

3(2H)-Isoquinolinone, 1,4-dihydro-1-phenyl-

CAS No.:
17507-05-0
Catalog Number:
AG002048
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
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Product Description
Catalog Number:
AG002048
Chemical Name:
3(2H)-Isoquinolinone, 1,4-dihydro-1-phenyl-
CAS Number:
17507-05-0
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
MDL Number:
MFCD00089450
IUPAC Name:
1-phenyl-2,4-dihydro-1H-isoquinolin-3-one
InChI:
InChI=1S/C15H13NO/c17-14-10-12-8-4-5-9-13(12)15(16-14)11-6-2-1-3-7-11/h1-9,15H,10H2,(H,16,17)
InChI Key:
IAOCKKZVKNCZPK-UHFFFAOYSA-N
SMILES:
O=C1Cc2ccccc2C(N1)c1ccccc1
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties