Home Halogens 6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylic acid

6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylic acid

CAS No.:
264276-41-7
Catalog Number:
AG01BEMS
Molecular Formula:
C10H8BrNO3
Molecular Weight:
270.0794
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Product Description
Catalog Number:
AG01BEMS
Chemical Name:
6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylic acid
CAS Number:
264276-41-7
Molecular Formula:
C10H8BrNO3
Molecular Weight:
270.0794
MDL Number:
MFCD26634312
IUPAC Name:
6-bromo-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylic acid
InChI:
InChI=1S/C10H8BrNO3/c11-5-1-2-8-6(3-5)7(10(14)15)4-9(13)12-8/h1-3,7H,4H2,(H,12,13)(H,14,15)
InChI Key:
PWVKWQYNGPHDFR-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccc(cc2C(C1)C(=O)O)Br
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.969g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.082g/mol
Monoisotopic Mass:
268.969g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties