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Home > Nitro Compounds > 5400-95-3
5400-95-3 | 1-(4-nitrophenyl)-3-phenylpropane-1,3-dione
CAS No: 5400-95-3 Catalog No: AG01DDW6 MDL No:MFCD00169031
Product Description
Catalog Number:
AG01DDW6
Chemical Name:
1-(4-nitrophenyl)-3-phenylpropane-1,3-dione
CAS Number:
5400-95-3
MDL Number:
MFCD00169031
IUPAC Name:
1-(4-nitrophenyl)-3-phenylpropane-1,3-dione
InChI:
InChI=1S/C15H11NO4/c17-14(11-4-2-1-3-5-11)10-15(18)12-6-8-13(9-7-12)16(19)20/h1-9H,10H2
InChI Key:
MIVNAJMLVLKIJI-UHFFFAOYSA-N
NSC Number:
10412
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.256g/mol
Monoisotopic Mass:
269.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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