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130820-63-2 | 4(1H)-Quinolinone, 2-(4-bromophenyl)-2,3-dihydro-
CAS No: 130820-63-2 Catalog No: AG000UZJ MDL No:
Product Description
Catalog Number:
AG000UZJ
Chemical Name:
4(1H)-Quinolinone, 2-(4-bromophenyl)-2,3-dihydro-
CAS Number:
130820-63-2
Molecular Formula:
C15H12BrNO
Molecular Weight:
302.1659
IUPAC Name:
2-(4-bromophenyl)-2,3-dihydro-1H-quinolin-4-one
InChI:
InChI=1S/C15H12BrNO/c16-11-7-5-10(6-8-11)14-9-15(18)12-3-1-2-4-13(12)17-14/h1-8,14,17H,9H2
InChI Key:
MVBJVBQIUSGFKC-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C1CC(=O)c2c(N1)cccc2
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.01g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.171g/mol
Monoisotopic Mass:
301.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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