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114312-17-3

114312-17-3 | 8(2H)-Quinolinone, 1,8a-dihydro-1-methyl-

CAS No: 114312-17-3 Catalog No: AG000B24 MDL No:

Product Description

Catalog Number:
AG000B24
Chemical Name:
8(2H)-Quinolinone, 1,8a-dihydro-1-methyl-
CAS Number:
114312-17-3
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
1-methyl-2,8a-dihydroquinolin-8-one
InChI:
InChI=1S/C10H11NO/c1-11-7-3-5-8-4-2-6-9(12)10(8)11/h2-6,10H,7H2,1H3
InChI Key:
VNDVRNWKVUWPDE-UHFFFAOYSA-N
SMILES:
CN1CC=CC2=CC=CC(=O)C12

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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