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Home > Nitro Compounds > 869464-84-6
869464-84-6 | N-(2-ethylphenyl)-3-(4-nitrophenyl)-3-oxopropanamide
CAS No: 869464-84-6 Catalog No: AG019ONK MDL No:MFCD07345577
Product Description
Catalog Number:
AG019ONK
Chemical Name:
N-(2-ethylphenyl)-3-(4-nitrophenyl)-3-oxopropanamide
CAS Number:
869464-84-6
Molecular Formula:
C17H16N2O4
Molecular Weight:
312.3199
MDL Number:
MFCD07345577
IUPAC Name:
N-(2-ethylphenyl)-3-(4-nitrophenyl)-3-oxopropanamide
InChI:
InChI=1S/C17H16N2O4/c1-2-12-5-3-4-6-15(12)18-17(21)11-16(20)13-7-9-14(10-8-13)19(22)23/h3-10H,2,11H2,1H3,(H,18,21)
InChI Key:
IODORNAGXSLTMJ-UHFFFAOYSA-N
SMILES:
CCc1ccccc1NC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.111g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.325g/mol
Monoisotopic Mass:
312.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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