Home Carboxys 6-methoxy-4-methyl-1H-indole-2-carboxylic acid

6-methoxy-4-methyl-1H-indole-2-carboxylic acid

CAS No.:
1158787-40-6
Catalog Number:
AG01DV09
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
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Product Description
Catalog Number:
AG01DV09
Chemical Name:
6-methoxy-4-methyl-1H-indole-2-carboxylic acid
CAS Number:
1158787-40-6
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD15176043
IUPAC Name:
6-methoxy-4-methyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C11H11NO3/c1-6-3-7(15-2)4-9-8(6)5-10(12-9)11(13)14/h3-5,12H,1-2H3,(H,13,14)
InChI Key:
OKJRMUCGQPFVFL-UHFFFAOYSA-N
SMILES:
COc1cc(C)c2c(c1)[nH]c(c2)C(=O)O
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties