Home Carboxys 2-cyclopropyl-6-methoxyquinoline-4-carboxylic acid

2-cyclopropyl-6-methoxyquinoline-4-carboxylic acid

CAS No.:
897565-71-8
Catalog Number:
AG01A17N
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
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Product Description
Catalog Number:
AG01A17N
Chemical Name:
2-cyclopropyl-6-methoxyquinoline-4-carboxylic acid
CAS Number:
897565-71-8
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
MDL Number:
MFCD05176306
IUPAC Name:
2-cyclopropyl-6-methoxyquinoline-4-carboxylic acid
InChI:
InChI=1S/C14H13NO3/c1-18-9-4-5-12-10(6-9)11(14(16)17)7-13(15-12)8-2-3-8/h4-8H,2-3H2,1H3,(H,16,17)
InChI Key:
NMVCLMGYUWYUDB-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(cc(n2)C1CC1)C(=O)O
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties