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143882-36-4 | 1(2H)-Isoquinolinone, 3-(2-hydroxyphenyl)-
CAS No: 143882-36-4 Catalog No: AG001IJF MDL No:
Product Description
Catalog Number:
AG001IJF
Chemical Name:
1(2H)-Isoquinolinone, 3-(2-hydroxyphenyl)-
CAS Number:
143882-36-4
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
IUPAC Name:
3-(2-hydroxyphenyl)-2H-isoquinolin-1-one
InChI:
InChI=1S/C15H11NO2/c17-14-8-4-3-7-12(14)13-9-10-5-1-2-6-11(10)15(18)16-13/h1-9,17H,(H,16,18)
InChI Key:
YPLPFTFLYMORIP-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1cc2ccccc2c(=O)[nH]1
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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