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Home > Nitro Compounds > 50891-29-7
50891-29-7 | 2-morpholino-5-nitrobenzamide
CAS No: 50891-29-7 Catalog No: AG00JGU4 MDL No:MFCD02050647
Product Description
Catalog Number:
AG00JGU4
Chemical Name:
2-morpholino-5-nitrobenzamide
CAS Number:
50891-29-7
Molecular Formula:
C11H13N3O4
Molecular Weight:
251.2386
MDL Number:
MFCD02050647
IUPAC Name:
2-morpholin-4-yl-5-nitrobenzamide
InChI:
InChI=1S/C11H13N3O4/c12-11(15)9-7-8(14(16)17)1-2-10(9)13-3-5-18-6-4-13/h1-2,7H,3-6H2,(H2,12,15)
InChI Key:
CNBIDKVMOLXLNT-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-]
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.091g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.242g/mol
Monoisotopic Mass:
251.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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