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14548-51-7 | 2(1H)-Quinolinone, 7-bromo-3,4-dihydro-
CAS No: 14548-51-7 Catalog No: AG001D2S MDL No:MFCD09878790
Product Description
Catalog Number:
AG001D2S
Chemical Name:
2(1H)-Quinolinone, 7-bromo-3,4-dihydro-
CAS Number:
14548-51-7
Molecular Formula:
C9H8BrNO
Molecular Weight:
226.0699
MDL Number:
MFCD09878790
IUPAC Name:
7-bromo-3,4-dihydro-1H-quinolin-2-one
InChI:
InChI=1S/C9H8BrNO/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1,3,5H,2,4H2,(H,11,12)
InChI Key:
JEZXCJXCRWALSO-UHFFFAOYSA-N
SMILES:
Brc1cc2NC(=O)CCc2cc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.073g/mol
Monoisotopic Mass:
224.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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