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Home > Nitro Compounds > 706767-32-0
706767-32-0 | Piperazine, 1-(5-nitro-2-thienyl)-4-(2-pyridinyl)-
CAS No: 706767-32-0 Catalog No: AG005SUO MDL No:
Product Description
Catalog Number:
AG005SUO
Chemical Name:
Piperazine, 1-(5-nitro-2-thienyl)-4-(2-pyridinyl)-
CAS Number:
706767-32-0
Molecular Formula:
C13H14N4O2S
Molecular Weight:
290.3409
IUPAC Name:
1-(5-nitrothiophen-2-yl)-4-pyridin-2-ylpiperazine
InChI:
InChI=1S/C13H14N4O2S/c18-17(19)13-5-4-12(20-13)16-9-7-15(8-10-16)11-3-1-2-6-14-11/h1-6H,7-10H2
InChI Key:
VBEOHBJEFKPGQR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(s1)N1CCN(CC1)c1ccccn1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.341g/mol
Monoisotopic Mass:
290.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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