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Home > Nitro Compounds > 68740-15-8
68740-15-8 | 4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-N-methyl-2-nitroaniline
CAS No: 68740-15-8 Catalog No: AG00FPR7 MDL No:
Product Description
Catalog Number:
AG00FPR7
Chemical Name:
4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-N-methyl-2-nitroaniline
CAS Number:
68740-15-8
IUPAC Name:
4-[(4-benzhydrylpiperazin-1-yl)methyl]-N-methyl-2-nitroaniline
InChI:
InChI=1S/C25H28N4O2/c1-26-23-13-12-20(18-24(23)29(30)31)19-27-14-16-28(17-15-27)25(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,25-26H,14-17,19H2,1H3
InChI Key:
WWXFIBXWRNTLTE-UHFFFAOYSA-N
EC Number:
272-131-3
Properties
Complexity:
530
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.221g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
416.525g/mol
Monoisotopic Mass:
416.221g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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