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Home > Nitro Compounds > 1017789-50-2
1017789-50-2 | 2-Propenamide, N-[2-(3,5-dinitrophenyl)ethyl]-
CAS No: 1017789-50-2 Catalog No: AG0005K1 MDL No:
Product Description
Catalog Number:
AG0005K1
Chemical Name:
2-Propenamide, N-[2-(3,5-dinitrophenyl)ethyl]-
CAS Number:
1017789-50-2
Molecular Formula:
C11H11N3O5
Molecular Weight:
265.2221
IUPAC Name:
N-[2-(3,5-dinitrophenyl)ethyl]prop-2-enamide
InChI:
InChI=1S/C11H11N3O5/c1-2-11(15)12-4-3-8-5-9(13(16)17)7-10(6-8)14(18)19/h2,5-7H,1,3-4H2,(H,12,15)
InChI Key:
SUVWVEQQAZBFCQ-UHFFFAOYSA-N
SMILES:
C=CC(=O)NCCc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.07g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.225g/mol
Monoisotopic Mass:
265.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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