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697801-47-1

697801-47-1 | 3(2H)-Isoquinolinone,1,4-dihydro-8-methoxy-(9CI)

CAS No: 697801-47-1 Catalog No: AG00FRW2 MDL No:

Product Description

Catalog Number:
AG00FRW2
Chemical Name:
3(2H)-Isoquinolinone,1,4-dihydro-8-methoxy-(9CI)
CAS Number:
697801-47-1
IUPAC Name:
8-methoxy-2,4-dihydro-1H-isoquinolin-3-one
InChI:
InChI=1S/C10H11NO2/c1-13-9-4-2-3-7-5-10(12)11-6-8(7)9/h2-4H,5-6H2,1H3,(H,11,12)
InChI Key:
PCFQGCOTGKPQNV-UHFFFAOYSA-N

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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