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1820664-84-3 | 4-Methanesulfonyl-1,2-dihydroisoquinolin-1-one
CAS No: 1820664-84-3 Catalog No: AG00I0PS MDL No:
Product Description
Catalog Number:
AG00I0PS
Chemical Name:
4-Methanesulfonyl-1,2-dihydroisoquinolin-1-one
CAS Number:
1820664-84-3
IUPAC Name:
4-methylsulfonyl-2H-isoquinolin-1-one
InChI:
InChI=1S/C10H9NO3S/c1-15(13,14)9-6-11-10(12)8-5-3-2-4-7(8)9/h2-6H,1H3,(H,11,12)
InChI Key:
AMRDPKKNIKAVCE-UHFFFAOYSA-N
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.03g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.246g/mol
Monoisotopic Mass:
223.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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