Home Halogens 7,8-dichloro-2-oxo-1,2-dihydroquinoline-3-carboxylic acid

7,8-dichloro-2-oxo-1,2-dihydroquinoline-3-carboxylic acid

CAS No.:
879067-97-7
Catalog Number:
AG01EKBY
Molecular Formula:
C10H5Cl2NO3
Molecular Weight:
258.0576
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Product Description
Catalog Number:
AG01EKBY
Chemical Name:
7,8-dichloro-2-oxo-1,2-dihydroquinoline-3-carboxylic acid
CAS Number:
879067-97-7
Molecular Formula:
C10H5Cl2NO3
Molecular Weight:
258.0576
MDL Number:
MFCD07403519
IUPAC Name:
7,8-dichloro-2-oxo-3H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C10H5Cl2NO3/c11-6-2-1-4-3-5(10(15)16)9(14)13-8(4)7(6)12/h1-3,5H,(H,15,16)
InChI Key:
KDWXLXNAIOBABK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2ccc(c(c2[nH]c1=O)Cl)Cl
Properties
Complexity:
514  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.965g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.054g/mol
Monoisotopic Mass:
256.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties