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Home > Nitro Compounds > 96103-52-5
96103-52-5 | 2-Nitro-5-(1-piperazinyl)aniline
CAS No: 96103-52-5 Catalog No: AG003HS6 MDL No:MFCD00545958
Product Description
Catalog Number:
AG003HS6
Chemical Name:
2-Nitro-5-(1-piperazinyl)aniline
CAS Number:
96103-52-5
Molecular Formula:
C10H14N4O2
Molecular Weight:
222.2438
MDL Number:
MFCD00545958
IUPAC Name:
2-nitro-5-piperazin-1-ylaniline
InChI:
InChI=1S/C10H14N4O2/c11-9-7-8(1-2-10(9)14(15)16)13-5-3-12-4-6-13/h1-2,7,12H,3-6,11H2
InChI Key:
GKHFASZRZGVHRT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1N)N1CCNCC1
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.112g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.248g/mol
Monoisotopic Mass:
222.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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