200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 88116-47-6
88116-47-6 | 1,3-Benzenedicarboxamide, N,N'-bis(2-hydroxyethyl)-5-nitro-
CAS No: 88116-47-6 Catalog No: AG004IRA MDL No:
Product Description
Catalog Number:
AG004IRA
Chemical Name:
1,3-Benzenedicarboxamide, N,N'-bis(2-hydroxyethyl)-5-nitro-
CAS Number:
88116-47-6
Molecular Formula:
C12H15N3O6
Molecular Weight:
297.2640
IUPAC Name:
1-N,3-N-bis(2-hydroxyethyl)-5-nitrobenzene-1,3-dicarboxamide
InChI:
InChI=1S/C12H15N3O6/c16-3-1-13-11(18)8-5-9(12(19)14-2-4-17)7-10(6-8)15(20)21/h5-7,16-17H,1-4H2,(H,13,18)(H,14,19)
InChI Key:
OJQUJZFLBYAQNM-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NCCO
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
297.267g/mol
Monoisotopic Mass:
297.096g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.