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Home > Nitro Compounds > 2059934-77-7
2059934-77-7 | 5-ethyl-3-methyl-2-nitrobenzamide
CAS No: 2059934-77-7 Catalog No: AG01BW80 MDL No:MFCD30476873
Product Description
Catalog Number:
AG01BW80
Chemical Name:
5-ethyl-3-methyl-2-nitrobenzamide
CAS Number:
2059934-77-7
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD30476873
IUPAC Name:
5-ethyl-3-methyl-2-nitrobenzamide
InChI:
InChI=1S/C10H12N2O3/c1-3-7-4-6(2)9(12(14)15)8(5-7)10(11)13/h4-5H,3H2,1-2H3,(H2,11,13)
InChI Key:
QTUGIDKZBVCCRX-UHFFFAOYSA-N
SMILES:
CCc1cc(C)c(c(c1)C(=O)N)[N+](=O)[O-]
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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