200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 198756-29-5
198756-29-5 | Ethanediamide, N1,N2-bis(1H-1,2,3-triazol-1-yl)-
CAS No: 198756-29-5 Catalog No: AG002BQ1 MDL No:
Product Description
Catalog Number:
AG002BQ1
Chemical Name:
Ethanediamide, N1,N2-bis(1H-1,2,3-triazol-1-yl)-
CAS Number:
198756-29-5
Molecular Formula:
C6H6N8O2
Molecular Weight:
222.1642
IUPAC Name:
N,N'-bis(triazol-1-yl)oxamide
InChI:
InChI=1S/C6H6N8O2/c15-5(9-13-3-1-7-11-13)6(16)10-14-4-2-8-12-14/h1-4H,(H,9,15)(H,10,16)
InChI Key:
XINOIPJHAWAPKD-UHFFFAOYSA-N
SMILES:
O=C(C(=O)Nn1ccnn1)Nn1ccnn1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.168g/mol
Monoisotopic Mass:
222.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.