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Home Halogens Methyl 8-chloro-4-oxo-1,4-dihydroquinoline-7-carboxylate

Methyl 8-chloro-4-oxo-1,4-dihydroquinoline-7-carboxylate

CAS No.:
948573-54-4
Catalog Number:
AG006RB3
Molecular Formula:
C11H8ClNO3
Molecular Weight:
237.6391
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Product Description
Catalog Number:
AG006RB3
Chemical Name:
Methyl 8-chloro-4-oxo-1,4-dihydroquinoline-7-carboxylate
CAS Number:
948573-54-4
Molecular Formula:
C11H8ClNO3
Molecular Weight:
237.6391
MDL Number:
MFCD11501427
IUPAC Name:
methyl 8-chloro-4-oxo-1H-quinoline-7-carboxylate
InChI:
InChI=1S/C11H8ClNO3/c1-16-11(15)7-3-2-6-8(14)4-5-13-10(6)9(7)12/h2-5H,1H3,(H,13,14)
InChI Key:
UERUOGNUVCRUFR-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1Cl)[nH]ccc2=O
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.019g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.639g/mol
Monoisotopic Mass:
237.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties