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Home Carboxys 4-Hydroxy-2-methylquinoline-6-carboxylic acid ethyl ester

4-Hydroxy-2-methylquinoline-6-carboxylic acid ethyl ester

CAS No.:
300590-94-7
Catalog Number:
AG00BC0P
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
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Purity
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1g
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$248
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2.5g
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5g
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$707
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10g
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25g
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50g
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Product Description
Catalog Number:
AG00BC0P
Chemical Name:
4-Hydroxy-2-methylquinoline-6-carboxylic acid ethyl ester
CAS Number:
300590-94-7
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
MDL Number:
MFCD00440392
IUPAC Name:
ethyl 2-methyl-4-oxo-1H-quinoline-6-carboxylate
InChI:
InChI=1S/C13H13NO3/c1-3-17-13(16)9-4-5-11-10(7-9)12(15)6-8(2)14-11/h4-7H,3H2,1-2H3,(H,14,15)
InChI Key:
ZBJWZYUUWDUKMK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2c(c1)c(O)cc(n2)C
NSC Number:
30291
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.251g/mol
Monoisotopic Mass:
231.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties