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37704-54-4 | 6,7-Dihydro-3-hydroxy-1,8(2H,5H)-isoquinolinedione
CAS No: 37704-54-4 Catalog No: AG00CUNU MDL No:
Product Description
Catalog Number:
AG00CUNU
Chemical Name:
6,7-Dihydro-3-hydroxy-1,8(2H,5H)-isoquinolinedione
CAS Number:
37704-54-4
IUPAC Name:
1-hydroxy-2,5,6,7-tetrahydroisoquinoline-3,8-dione
InChI:
InChI=1S/C9H9NO3/c11-6-3-1-2-5-4-7(12)10-9(13)8(5)6/h4H,1-3H2,(H2,10,12,13)
InChI Key:
VJKJPPQJZHGUQP-UHFFFAOYSA-N
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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