Home Halogens 5-chloro-2-methylquinoline-3-carboxylic acid

5-chloro-2-methylquinoline-3-carboxylic acid

CAS No.:
2060030-02-4
Catalog Number:
AG01BS7K
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
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Product Description
Catalog Number:
AG01BS7K
Chemical Name:
5-chloro-2-methylquinoline-3-carboxylic acid
CAS Number:
2060030-02-4
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD30536086
IUPAC Name:
5-chloro-2-methylquinoline-3-carboxylic acid
InChI:
InChI=1S/C11H8ClNO2/c1-6-7(11(14)15)5-8-9(12)3-2-4-10(8)13-6/h2-5H,1H3,(H,14,15)
InChI Key:
PKWCPDWRLIDOBO-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c(Cl)cccc2nc1C
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties