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Home > Imidazoles > 77162-60-8
77162-60-8 | 4-[6-(2-nitroimidazol-1-yl)hexyl]morpholine
CAS No: 77162-60-8 Catalog No: AG005PCK MDL No:
Product Description
Catalog Number:
AG005PCK
Chemical Name:
4-[6-(2-nitroimidazol-1-yl)hexyl]morpholine
CAS Number:
77162-60-8
Molecular Formula:
C13H22N4O3
Molecular Weight:
282.3388
IUPAC Name:
4-[6-(2-nitroimidazol-1-yl)hexyl]morpholine
InChI:
InChI=1S/C13H22N4O3/c18-17(19)13-14-5-8-16(13)7-4-2-1-3-6-15-9-11-20-12-10-15/h5,8H,1-4,6-7,9-12H2
InChI Key:
TVYINGBJVCTMMA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1nccn1CCCCCCN1CCOCC1
NSC Number:
309929
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.169g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.344g/mol
Monoisotopic Mass:
282.169g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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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