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23789-96-0 | 7-Chloro-1-methyl-4-oxo-1
CAS No: 23789-96-0 Catalog No: AG01FO5S MDL No:
Product Description
Catalog Number:
AG01FO5S
Chemical Name:
7-Chloro-1-methyl-4-oxo-1
CAS Number:
23789-96-0
IUPAC Name:
7-chloro-1-methyl-4-oxoquinoline-3-carboxylic acid
InChI:
InChI=1S/C11H8ClNO3/c1-13-5-8(11(15)16)10(14)7-3-2-6(12)4-9(7)13/h2-5H,1H3,(H,15,16)
InChI Key:
UEZCMDFHCHWUFM-UHFFFAOYSA-N
Properties
Complexity:
366
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:
1
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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