Home Carboxys 6-(propan-2-yl)-1H-indole-2-carboxylic acid

6-(propan-2-yl)-1H-indole-2-carboxylic acid

CAS No.:
383132-73-8
Catalog Number:
AG00I7L2
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
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Product Description
Catalog Number:
AG00I7L2
Chemical Name:
6-(propan-2-yl)-1H-indole-2-carboxylic acid
CAS Number:
383132-73-8
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD00463510
IUPAC Name:
6-propan-2-yl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C12H13NO2/c1-7(2)8-3-4-9-6-11(12(14)15)13-10(9)5-8/h3-7,13H,1-2H3,(H,14,15)
InChI Key:
DPDMFBGWQRIYBU-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)[nH]c(c2)C(=O)O)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties