Home Carboxys 6-Bromo-4-indole carboxylic acid

6-Bromo-4-indole carboxylic acid

CAS No.:
898746-91-3
Catalog Number:
AG003N3J
Molecular Formula:
C9H6BrNO2
Molecular Weight:
240.0534
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$33
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Product Description
Catalog Number:
AG003N3J
Chemical Name:
6-Bromo-4-indole carboxylic acid
CAS Number:
898746-91-3
Molecular Formula:
C9H6BrNO2
Molecular Weight:
240.0534
MDL Number:
MFCD08458974
IUPAC Name:
6-bromo-1H-indole-4-carboxylic acid
InChI:
InChI=1S/C9H6BrNO2/c10-5-3-7(9(12)13)6-1-2-11-8(6)4-5/h1-4,11H,(H,12,13)
InChI Key:
LIXZNRVUWPYCNC-UHFFFAOYSA-N
SMILES:
Brc1cc(C(=O)O)c2c(c1)[nH]cc2
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.958g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
240.056g/mol
Monoisotopic Mass:
238.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties