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Home Carboxys 6-Bromo-1h-indole-3-carboxylic acid

6-Bromo-1h-indole-3-carboxylic acid

CAS No.:
101774-27-0
Catalog Number:
AG0005GI
Molecular Formula:
C9H6BrNO2
Molecular Weight:
240.0534
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$55
- +
5g
96%
In Stock USA
United States
$200
- +
10g
96%
In Stock USA
United States
$350
- +
25g
96%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG0005GI
Chemical Name:
6-Bromo-1h-indole-3-carboxylic acid
CAS Number:
101774-27-0
Molecular Formula:
C9H6BrNO2
Molecular Weight:
240.0534
MDL Number:
MFCD05664008
IUPAC Name:
6-bromo-1H-indole-3-carboxylic acid
InChI:
InChI=1S/C9H6BrNO2/c10-5-1-2-6-7(9(12)13)4-11-8(6)3-5/h1-4,11H,(H,12,13)
InChI Key:
INNZWYJJSSRJET-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)[nH]cc2C(=O)O
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:
2.7  
Literature
Title Journal
Halogenated indole alkaloids from marine invertebrates. Marine drugs 20100101
Leptoclinidamines A-C, indole alkaloids from the Australian ascidian Leptoclinides durus. Journal of natural products 20090401
Properties