Home Carboxys 3,5,7-Trimethyl-1H-indole-2-carboxylic acid

3,5,7-Trimethyl-1H-indole-2-carboxylic acid

CAS No.:
876715-82-1
Catalog Number:
AG008E1S
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
10g
95%
In Stock USA
United States
$343
- +
Product Description
Catalog Number:
AG008E1S
Chemical Name:
3,5,7-Trimethyl-1H-indole-2-carboxylic acid
CAS Number:
876715-82-1
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD07186365
IUPAC Name:
3,5,7-trimethyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C12H13NO2/c1-6-4-7(2)10-9(5-6)8(3)11(13-10)12(14)15/h4-5,13H,1-3H3,(H,14,15)
InChI Key:
XFNONUNNILCXRU-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(c1)c(C)c([nH]2)C(=O)O
Properties
Complexity:
266  
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:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties