200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1000341-50-3
1000341-50-3 | 1H-Indole-2,4,6-tricarboxylic acid
CAS No: 1000341-50-3 Catalog No: AG0000GD MDL No:
Product Description
Catalog Number:
AG0000GD
Chemical Name:
1H-Indole-2,4,6-tricarboxylic acid
CAS Number:
1000341-50-3
Molecular Formula:
C11H7NO6
Molecular Weight:
249.1764
IUPAC Name:
1H-indole-2,4,6-tricarboxylic acid
InChI:
InChI=1S/C11H7NO6/c13-9(14)4-1-6(10(15)16)5-3-8(11(17)18)12-7(5)2-4/h1-3,12H,(H,13,14)(H,15,16)(H,17,18)
InChI Key:
AYOFZQNDOANLSQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2[nH]c(cc2c(c1)C(=O)O)C(=O)O
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.027g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
249.178g/mol
Monoisotopic Mass:
249.027g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.