Home Carboxys 6-tert-Butyl-1h-indole-2-carboxylic acid

6-tert-Butyl-1h-indole-2-carboxylic acid

CAS No.:
383133-22-0
Catalog Number:
AG00I7L5
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$300
- +
1g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00I7L5
Chemical Name:
6-tert-Butyl-1h-indole-2-carboxylic acid
CAS Number:
383133-22-0
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
MDL Number:
MFCD02664506
IUPAC Name:
6-tert-butyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C13H15NO2/c1-13(2,3)9-5-4-8-6-11(12(15)16)14-10(8)7-9/h4-7,14H,1-3H3,(H,15,16)
InChI Key:
LDUYCWKFEAHQRF-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)cc(cc2)C(C)(C)C
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties