200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 894-86-0
894-86-0 | [2,2'-Bi-1H-indole]-3,3'-diol,sodium salt (1:2)
CAS No: 894-86-0 Catalog No: AG00422E MDL No:
Product Description
Catalog Number:
AG00422E
Chemical Name:
[2,2'-Bi-1H-indole]-3,3'-diol,sodium salt (1:2)
CAS Number:
894-86-0
Molecular Formula:
C16H10N2Na2O2
Molecular Weight:
308.2423
IUPAC Name:
disodium;2-(3-oxido-1H-indol-2-yl)-1H-indol-3-olate
InChI:
InChI=1S/C16H12N2O2.2Na/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14;;/h1-8,17-20H;;/q;2*+1/p-2
InChI Key:
CMSRLFLXFXUENW-UHFFFAOYSA-L
SMILES:
[O-]c1c([nH]c2c1cccc2)c1[nH]c2c(c1[O-])cccc2.[Na+].[Na+]
EC Number:
212-974-6
UNII:
VFK9F739AB
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.054g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
308.248g/mol
Monoisotopic Mass:
308.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.