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209286-01-1 | 6-METHOXY-7-METHYLISOQUINOLIN-1(2H)-ONE
CAS No: 209286-01-1 Catalog No: AG00CFTN MDL No:
Product Description
Catalog Number:
AG00CFTN
Chemical Name:
6-METHOXY-7-METHYLISOQUINOLIN-1(2H)-ONE
CAS Number:
209286-01-1
IUPAC Name:
6-methoxy-7-methyl-2H-isoquinolin-1-one
InChI:
InChI=1S/C11H11NO2/c1-7-5-9-8(6-10(7)14-2)3-4-12-11(9)13/h3-6H,1-2H3,(H,12,13)
InChI Key:
CGWGBFQQDBALGU-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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