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14805-54-0

14805-54-0 | Ethanediamide, N1,N2-bis(2,4-dinitrophenyl)-

CAS No: 14805-54-0 Catalog No: AG001FE3 MDL No:

Product Description

Catalog Number:
AG001FE3
Chemical Name:
Ethanediamide, N1,N2-bis(2,4-dinitrophenyl)-
CAS Number:
14805-54-0
Molecular Formula:
C14H8N6O10
Molecular Weight:
420.2475
IUPAC Name:
N,N'-bis(2,4-dinitrophenyl)oxamide
InChI:
InChI=1S/C14H8N6O10/c21-13(15-9-3-1-7(17(23)24)5-11(9)19(27)28)14(22)16-10-4-2-8(18(25)26)6-12(10)20(29)30/h1-6H,(H,15,21)(H,16,22)
InChI Key:
NRBLVWUJTCZMHI-UHFFFAOYSA-N
SMILES:
O=C(C(=O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
EC Number:
238-872-1

Properties

Complexity:
676  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.03g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
420.25g/mol
Monoisotopic Mass:
420.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
242A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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