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23543-31-9 | Acetamide, 2-bromo-N-methyl-N-(4-nitrophenyl)-
CAS No: 23543-31-9 Catalog No: AG002NMZ MDL No:
Product Description
Catalog Number:
AG002NMZ
Chemical Name:
Acetamide, 2-bromo-N-methyl-N-(4-nitrophenyl)-
CAS Number:
23543-31-9
Molecular Formula:
C9H9BrN2O3
Molecular Weight:
273.0834
IUPAC Name:
2-bromo-N-methyl-N-(4-nitrophenyl)acetamide
InChI:
InChI=1S/C9H9BrN2O3/c1-11(9(13)6-10)7-2-4-8(5-3-7)12(14)15/h2-5H,6H2,1H3
InChI Key:
MHYGOCXPOWBZGK-UHFFFAOYSA-N
SMILES:
BrCC(=O)N(c1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.98g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.086g/mol
Monoisotopic Mass:
271.98g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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