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1794791-19-7 | 5-Nitro-1H-imidazole-1-ethanol-d4
CAS No: 1794791-19-7 Catalog No: AG01E2YD MDL No:
Product Description
Catalog Number:
AG01E2YD
Chemical Name:
5-Nitro-1H-imidazole-1-ethanol-d4
CAS Number:
1794791-19-7
IUPAC Name:
1,1,2,2-tetradeuterio-2-(5-nitroimidazol-1-yl)ethanol
InChI:
InChI=1S/C5H7N3O3/c9-2-1-7-4-6-3-5(7)8(10)11/h3-4,9H,1-2H2/i1D2,2D2
InChI Key:
DFMZECOLZRIPOT-LNLMKGTHSA-N
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
4
Molecular Weight:
161.153g/mol
Monoisotopic Mass:
161.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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