Home Halogens 7-chloro-3-(propan-2-yl)-1,2,3,4-tetrahydroquinoxalin-2-one

7-chloro-3-(propan-2-yl)-1,2,3,4-tetrahydroquinoxalin-2-one

CAS No.:
146741-02-8
Catalog Number:
AG01DVC5
Molecular Formula:
C11H13ClN2O
Molecular Weight:
224.6867
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Product Description
Catalog Number:
AG01DVC5
Chemical Name:
7-chloro-3-(propan-2-yl)-1,2,3,4-tetrahydroquinoxalin-2-one
CAS Number:
146741-02-8
Molecular Formula:
C11H13ClN2O
Molecular Weight:
224.6867
MDL Number:
MFCD21840795
IUPAC Name:
7-chloro-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
InChI:
InChI=1S/C11H13ClN2O/c1-6(2)10-11(15)14-9-5-7(12)3-4-8(9)13-10/h3-6,10,13H,1-2H3,(H,14,15)
InChI Key:
JAPONFFVJBBUMD-UHFFFAOYSA-N
SMILES:
CC(C1Nc2ccc(cc2NC1=O)Cl)C
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.072g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.688g/mol
Monoisotopic Mass:
224.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties