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1019-03-0,MFCD01325647
Catalog No.:AA0005SP
1019-03-0 | 2-Propylquinoline-4-carboxylic acid
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0005SP
Chemical Name:
2-Propylquinoline-4-carboxylic acid
CAS Number:
1019-03-0
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
MDL Number:
MFCD01325647
IUPAC Name:
2-propylquinoline-4-carboxylic acid
InChI:
InChI=1S/C13H13NO2/c1-2-5-9-8-11(13(15)16)10-6-3-4-7-12(10)14-9/h3-4,6-8H,2,5H2,1H3,(H,15,16)
InChI Key:
GHWNIFKWPIVEPC-UHFFFAOYSA-N
SMILES:
CCCc1nc2ccccc2c(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
2-propylquinoline-4-carboxylic acid 
1019-03-0 
CHEMBL1472584 
DTXSID50357576 
HMS2445G18 
ZINC406244 
ALBB-011587 
7484AC 
BBL013723 
MFCD01325647 
STK332727 
AKOS003297060 
2-propyl-4-quinolinecarboxylic acid 
MCULE-9120023633 
SMR000136320 
FT-0683350 
R4430 
ST45055915 
AK-968/40159198 
SR-01000256990 
I04-4196 
SR-01000256990-1 
Z275123336 
4-quinolinecarboxylic acid, 2-propyl- 
C13H13NO2 
CID854375 
MLS000531342 
AC1LGZJY 
AC1Q2V1R 
Cambridge id 7270977 
Oprea1_200991 
SCHEMBL1133916 
Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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