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Home > Nitro Compounds > 27853-78-7
27853-78-7 | Cyclohexanone, 5-methyl-2-(1-methylethyl)-, 2-(2,4-dinitrophenyl)hydrazone, (2R,5S)-rel-
CAS No: 27853-78-7 Catalog No: AG002UYB MDL No:
Product Description
Catalog Number:
AG002UYB
Chemical Name:
Cyclohexanone, 5-methyl-2-(1-methylethyl)-, 2-(2,4-dinitrophenyl)hydrazone, (2R,5S)-rel-
CAS Number:
27853-78-7
IUPAC Name:
N-[(5-methyl-2-propan-2-ylcyclohexylidene)amino]-2,4-dinitroaniline
InChI:
InChI=1S/C16H22N4O4/c1-10(2)13-6-4-11(3)8-15(13)18-17-14-7-5-12(19(21)22)9-16(14)20(23)24/h5,7,9-11,13,17H,4,6,8H2,1-3H3
InChI Key:
KOPXDHJXCKPXDC-UHFFFAOYSA-N
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.164g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
334.376g/mol
Monoisotopic Mass:
334.164g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
5.1
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