Name: Name:7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Brand: Angene
SKU: AG003NE1
Rating: 90 (10 reviews)

7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

CAS No.:

68077-26-9

Catalog Number:

AG003NE1

Molecular Formula:

C12H9ClFNO3

Molecular Weight:

269.6562

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Catalog Number:

AG003NE1

Chemical Name:

7-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

CAS Number:

68077-26-9

Molecular Formula:

C12H9ClFNO3

Molecular Weight:

269.6562

MDL Number:

MFCD00792459

IUPAC Name:

7-chloro-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

InChI:

InChI=1S/C12H9ClFNO3/c1-2-15-5-7(12(17)18)11(16)6-3-9(14)8(13)4-10(6)15/h3-5H,2H2,1H3,(H,17,18)

InChI Key:

WNNSMMJBBOPPOT-UHFFFAOYSA-N

SMILES:

CCn1cc(C(=O)O)c(=O)c2c1cc(Cl)c(c2)F

EC Number:

614-262-4

UNII:

831B5OC9PQ

Complexity:

412

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.025g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.656g/mol

Monoisotopic Mass:

269.025g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4