Home Carboxys 1H-Indole-2-carboxylicacid, 4,7-dimethyl-

1H-Indole-2-carboxylicacid, 4,7-dimethyl-

CAS No.:
103988-96-1
Catalog Number:
AG007F7W
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
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Product Description
Catalog Number:
AG007F7W
Chemical Name:
1H-Indole-2-carboxylicacid, 4,7-dimethyl-
CAS Number:
103988-96-1
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD02664423
IUPAC Name:
4,7-dimethyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C11H11NO2/c1-6-3-4-7(2)10-8(6)5-9(12-10)11(13)14/h3-5,12H,1-2H3,(H,13,14)
InChI Key:
DXGLNXJHHJNUHD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)c(C)ccc2C
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:
2  
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties