Home Halogens 3-Acetyl-6-bromoquinoline-4-carboxylic acid

3-Acetyl-6-bromoquinoline-4-carboxylic acid

CAS No.:
444112-84-9
Catalog Number:
AG01EVZM
Molecular Formula:
C12H8BrNO3
Molecular Weight:
294.1008
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$757
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Product Description
Catalog Number:
AG01EVZM
Chemical Name:
3-Acetyl-6-bromoquinoline-4-carboxylic acid
CAS Number:
444112-84-9
Molecular Formula:
C12H8BrNO3
Molecular Weight:
294.1008
MDL Number:
MFCD03196271
IUPAC Name:
3-acetyl-6-bromoquinoline-4-carboxylic acid
InChI:
InChI=1S/C12H8BrNO3/c1-6(15)9-5-14-10-3-2-7(13)4-8(10)11(9)12(16)17/h2-5H,1H3,(H,16,17)
InChI Key:
ABDYMAVASLQHTA-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(C(=O)O)c(cn2)C(=O)C
Properties
Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.969g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
294.104g/mol
Monoisotopic Mass:
292.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties