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10222-61-4,MFCD11527607
Catalog No.:AA0006W6
10222-61-4 | 2-Butoxyquinoline-4-carboxylic acid
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Purity
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Price(USD)
Quantity
  
250mg
98%
in stock  
$103.00   $72.00
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1g
98%
in stock  
$256.00   $180.00
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Technical Information
Catalog Number:
AA0006W6
Chemical Name:
2-Butoxyquinoline-4-carboxylic acid
CAS Number:
10222-61-4
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
MDL Number:
MFCD11527607
IUPAC Name:
2-butoxyquinoline-4-carboxylic acid
InChI:
InChI=1S/C14H15NO3/c1-2-3-8-18-13-9-11(14(16)17)10-6-4-5-7-12(10)15-13/h4-7,9H,2-3,8H2,1H3,(H,16,17)
InChI Key:
ZISCTCXYESUBGA-UHFFFAOYSA-N
SMILES:
CCCCOc1nc2ccccc2c(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

Synonyms
 
2-butoxyquinoline-4-carboxylic Acid 
10222-61-4 
MFCD11527607 
ZINC34083382 
2-n-Butoxy-4-quinolinecarboxylic acid 
AKOS009411458 
IMED409272673 
ACN-052840 
DS-9690 
AJ-86853 
AX8293080 
ST24040225 
4-Quinolinecarboxylic acid, 2-butoxy- 
W-3776 
CID10014750 
AK159821 
2-(n-butyloxy)-4-quinolinecarboxylic acid 
butyloxycinchoninic acid 
SCHEMBL6250517 
KS-00000SIU 
ZISCTCXYESUBGA-UHFFFAOYSA-N 
2-Butoxyquinoline-4-carboxylicAcid 
Literature
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