Home Carboxys 1,5-Dimethyl-1h-indole-2-carboxylic acid

1,5-Dimethyl-1h-indole-2-carboxylic acid

CAS No.:
216210-59-2
Catalog Number:
AG00C1ZK
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
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Product Description
Catalog Number:
AG00C1ZK
Chemical Name:
1,5-Dimethyl-1h-indole-2-carboxylic acid
CAS Number:
216210-59-2
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD03848206
IUPAC Name:
1,5-dimethylindole-2-carboxylic acid
InChI:
InChI=1S/C11H11NO2/c1-7-3-4-9-8(5-7)6-10(11(13)14)12(9)2/h3-6H,1-2H3,(H,13,14)
InChI Key:
WBVJWABYADZXNO-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)cc(n2C)C(=O)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties