Home Bromides 1001756-23-5
1001756-23-5,MFCD09834664
Catalog No.:AA00012C
1001756-23-5 | 3-Quinolinecarboxylic acid, 7-bromo-, methyl ester
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100mg
98%
1 week  
$87.00
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250mg
98%
1 week  
$139.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00012C
Chemical Name:
3-Quinolinecarboxylic acid, 7-bromo-, methyl ester
CAS Number:
1001756-23-5
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
MDL Number:
MFCD09834664
IUPAC Name:
methyl 7-bromoquinoline-3-carboxylate
InChI:
InChI=1S/C11H8BrNO2/c1-15-11(14)8-4-7-2-3-9(12)5-10(7)13-6-8/h2-6H,1H3
InChI Key:
GPLUSJRHUJLUHU-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc2c(c1)ccc(c2)Br
Properties
Computed Properties
 
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.094g/mol
Monoisotopic Mass:
264.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
Methyl 7-bromoquinoline-3-carboxylate 
1001756-23-5 
DS-5944 
DA-48450 
AJ-135306 
AX8259586 
ST2407302 
4CH-017606 
FT-0768900 
3-Quinolinecarboxylic acid, 7-bromo-, methyl ester 
AK138037 
SCHEMBL2001821 
DTXSID60731520 
GPLUSJRHUJLUHU-UHFFFAOYSA-N 
MFCD09834664 
ZINC95910898 
methyl 7-bromo-3-quinolinecarboxylate 
AKOS022173631 
Literature
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