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Home > Nitro Compounds > 56808-98-1
56808-98-1 | N,N-Diisobutyl-3,5-dinitrobenzamide
CAS No: 56808-98-1 Catalog No: AG00IA4J MDL No:
Product Description
Catalog Number:
AG00IA4J
Chemical Name:
N,N-Diisobutyl-3,5-dinitrobenzamide
CAS Number:
56808-98-1
IUPAC Name:
N,N-bis(2-methylpropyl)-3,5-dinitrobenzamide
InChI:
InChI=1S/C15H21N3O5/c1-10(2)8-16(9-11(3)4)15(19)12-5-13(17(20)21)7-14(6-12)18(22)23/h5-7,10-11H,8-9H2,1-4H3
InChI Key:
GZFKKDAEBLDFED-UHFFFAOYSA-N
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.148g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.349g/mol
Monoisotopic Mass:
323.148g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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