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Home > Nitro Compounds > 62884-26-8
62884-26-8 | 7-[4-(2-Methoxyphenyl)-1-piperazinyl]-4-nitrobenzofurazane 1-oxide
CAS No: 62884-26-8 Catalog No: AG00F5PY MDL No:
Product Description
Catalog Number:
AG00F5PY
Chemical Name:
7-[4-(2-Methoxyphenyl)-1-piperazinyl]-4-nitrobenzofurazane 1-oxide
CAS Number:
62884-26-8
IUPAC Name:
4-[4-(2-methoxyphenyl)piperazin-1-yl]-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
InChI:
InChI=1S/C17H17N5O5/c1-26-15-5-3-2-4-12(15)19-8-10-20(11-9-19)14-7-6-13(21(23)24)16-17(14)22(25)27-18-16/h2-7H,8-11H2,1H3
InChI Key:
WZXKCRLOVJWYHO-UHFFFAOYSA-N
NSC Number:
228107
Properties
Complexity:
526
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.123g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
371.353g/mol
Monoisotopic Mass:
371.123g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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