Home Halogens 8-chloro-4-methylquinoline-3-carboxylic acid

8-chloro-4-methylquinoline-3-carboxylic acid

CAS No.:
1510949-38-8
Catalog Number:
AG01C0EG
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
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Product Description
Catalog Number:
AG01C0EG
Chemical Name:
8-chloro-4-methylquinoline-3-carboxylic acid
CAS Number:
1510949-38-8
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD26598716
IUPAC Name:
8-chloro-4-methylquinoline-3-carboxylic acid
InChI:
InChI=1S/C11H8ClNO2/c1-6-7-3-2-4-9(12)10(7)13-5-8(6)11(14)15/h2-5H,1H3,(H,14,15)
InChI Key:
OPQBUGARAURYKY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1C)cccc2Cl
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