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Home > Nitro Compounds > 685892-20-0
685892-20-0 | Ethanone, 1-(5-ethyl-2-methoxy-3-nitrophenyl)- (9CI)
CAS No: 685892-20-0 Catalog No: AG00FF6O MDL No:MFCD03789146
Product Description
Catalog Number:
AG00FF6O
Chemical Name:
Ethanone, 1-(5-ethyl-2-methoxy-3-nitrophenyl)- (9CI)
CAS Number:
685892-20-0
MDL Number:
MFCD03789146
IUPAC Name:
1-(5-ethyl-2-methoxy-3-nitrophenyl)ethanone
InChI:
InChI=1S/C11H13NO4/c1-4-8-5-9(7(2)13)11(16-3)10(6-8)12(14)15/h5-6H,4H2,1-3H3
InChI Key:
MIKMQTBFVWNHMR-UHFFFAOYSA-N
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.228g/mol
Monoisotopic Mass:
223.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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