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Home > Nitro Compounds > 1497433-33-6
1497433-33-6 | (E)-1-METHYL-3-(4-NITROBENZYLIDENE)PIPERIDIN-4-ONE
CAS No: 1497433-33-6 Catalog No: AG01DLEX MDL No:
Product Description
Catalog Number:
AG01DLEX
Chemical Name:
(E)-1-METHYL-3-(4-NITROBENZYLIDENE)PIPERIDIN-4-ONE
CAS Number:
1497433-33-6
IUPAC Name:
1-methyl-3-[(4-nitrophenyl)methylidene]piperidin-4-one
InChI:
InChI=1S/C13H14N2O3/c1-14-7-6-13(16)11(9-14)8-10-2-4-12(5-3-10)15(17)18/h2-5,8H,6-7,9H2,1H3
InChI Key:
LVMQRIWLHIRTOM-UHFFFAOYSA-N
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.266g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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