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Home > Nitro Compounds > 1956355-57-9
1956355-57-9 | Ethyl 3-methyl-4-(4-nitrophenyl)-4-oxobutanoate
CAS No: 1956355-57-9 Catalog No: AG01EDON MDL No:
Product Description
Catalog Number:
AG01EDON
Chemical Name:
Ethyl 3-methyl-4-(4-nitrophenyl)-4-oxobutanoate
CAS Number:
1956355-57-9
IUPAC Name:
ethyl 3-methyl-4-(4-nitrophenyl)-4-oxobutanoate
InChI:
InChI=1S/C13H15NO5/c1-3-19-12(15)8-9(2)13(16)10-4-6-11(7-5-10)14(17)18/h4-7,9H,3,8H2,1-2H3
InChI Key:
CLPQHNFHIUEVPR-UHFFFAOYSA-N
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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