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116489-99-7 | Acetamide, N-(4-chloro-3-nitrophenyl)-N-ethyl-
CAS No: 116489-99-7 Catalog No: AG000CMZ MDL No:
Product Description
Catalog Number:
AG000CMZ
Chemical Name:
Acetamide, N-(4-chloro-3-nitrophenyl)-N-ethyl-
CAS Number:
116489-99-7
Molecular Formula:
C10H11ClN2O3
Molecular Weight:
242.6589
IUPAC Name:
N-(4-chloro-3-nitrophenyl)-N-ethylacetamide
InChI:
InChI=1S/C10H11ClN2O3/c1-3-12(7(2)14)8-4-5-9(11)10(6-8)13(15)16/h4-6H,3H2,1-2H3
InChI Key:
NKUBUAFRFMCCPJ-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.659g/mol
Monoisotopic Mass:
242.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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