Home Halogens 6-(2-bromopropanoyl)-1,2,3,4-tetrahydroquinolin-2-one

6-(2-bromopropanoyl)-1,2,3,4-tetrahydroquinolin-2-one

CAS No.:
62618-72-8
Catalog Number:
AG01AB0W
Molecular Formula:
C12H12BrNO2
Molecular Weight:
282.1332
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Product Description
Catalog Number:
AG01AB0W
Chemical Name:
6-(2-bromopropanoyl)-1,2,3,4-tetrahydroquinolin-2-one
CAS Number:
62618-72-8
Molecular Formula:
C12H12BrNO2
Molecular Weight:
282.1332
MDL Number:
MFCD11103549
IUPAC Name:
6-(2-bromopropanoyl)-3,4-dihydro-1H-quinolin-2-one
InChI:
InChI=1S/C12H12BrNO2/c1-7(13)12(16)9-2-4-10-8(6-9)3-5-11(15)14-10/h2,4,6-7H,3,5H2,1H3,(H,14,15)
InChI Key:
LJJPTQNZBAIGAX-UHFFFAOYSA-N
SMILES:
O=C1CCc2c(N1)ccc(c2)C(=O)C(Br)C
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.005g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
282.137g/mol
Monoisotopic Mass:
281.005g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties