200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 945017-57-2
945017-57-2 | 1,3-DIMETHYLIMIDAZOLIUM BICARBONATE
CAS No: 945017-57-2 Catalog No: AG00H6CG MDL No:
Product Description
Catalog Number:
AG00H6CG
Chemical Name:
1,3-DIMETHYLIMIDAZOLIUM BICARBONATE
CAS Number:
945017-57-2
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
IUPAC Name:
1,3-dimethylimidazol-1-ium;hydrogen carbonate
InChI:
InChI=1S/C5H9N2.CH2O3/c1-6-3-4-7(2)5-6;2-1(3)4/h3-5H,1-2H3;(H2,2,3,4)/q+1;/p-1
InChI Key:
CFCNWHQKGUZEDB-UHFFFAOYSA-M
SMILES:
Cn1cc[n+](c1)C.[O-]C(=O)O
Properties
Complexity:
79.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.157g/mol
Monoisotopic Mass:
158.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.