200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 188835-54-3
188835-54-3 | Propanedioic acid, 2-[(2,4-dinitrophenoxy)imino]-, 1,3-dimethyl ester
CAS No: 188835-54-3 Catalog No: AG002HEA MDL No:
Product Description
Catalog Number:
AG002HEA
Chemical Name:
Propanedioic acid, 2-[(2,4-dinitrophenoxy)imino]-, 1,3-dimethyl ester
CAS Number:
188835-54-3
Molecular Formula:
C11H9N3O9
Molecular Weight:
327.2039
IUPAC Name:
dimethyl 2-(2,4-dinitrophenoxy)iminopropanedioate
InChI:
InChI=1S/C11H9N3O9/c1-21-10(15)9(11(16)22-2)12-23-8-4-3-6(13(17)18)5-7(8)14(19)20/h3-5H,1-2H3
InChI Key:
BFNIBNVZAUSLAJ-UHFFFAOYSA-N
SMILES:
COC(=O)C(=NOc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)OC
Properties
Complexity:
504
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.034g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.205g/mol
Monoisotopic Mass:
327.034g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.