Home Aminos 3-(dimethylamino)-1,2-dihydroisoquinolin-1-one

3-(dimethylamino)-1,2-dihydroisoquinolin-1-one

CAS No.:
33035-87-9
Catalog Number:
AG019MPF
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
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Product Description
Catalog Number:
AG019MPF
Chemical Name:
3-(dimethylamino)-1,2-dihydroisoquinolin-1-one
CAS Number:
33035-87-9
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD11099446
IUPAC Name:
3-(dimethylamino)-2H-isoquinolin-1-one
InChI:
InChI=1S/C11H12N2O/c1-13(2)10-7-8-5-3-4-6-9(8)11(14)12-10/h3-7H,1-2H3,(H,12,14)
InChI Key:
XMXNFXJQGSVAHW-UHFFFAOYSA-N
SMILES:
CN(c1cc2ccccc2c(=O)[nH]1)C
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties