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128564-63-6 | 1H-Pyrazole-1-ethanol, 5-amino-4-nitroso-
CAS No: 128564-63-6 Catalog No: AG000Y7V MDL No:
Product Description
Catalog Number:
AG000Y7V
Chemical Name:
1H-Pyrazole-1-ethanol, 5-amino-4-nitroso-
CAS Number:
128564-63-6
Molecular Formula:
C5H8N4O2
Molecular Weight:
156.1426
IUPAC Name:
2-(5-amino-4-nitrosopyrazol-1-yl)ethanol
InChI:
InChI=1S/C5H8N4O2/c6-5-4(8-11)3-7-9(5)1-2-10/h3,10H,1-2,6H2
InChI Key:
IAJHVTSGFRHQMT-UHFFFAOYSA-N
SMILES:
Nc1c(cnn1CCO)N=O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.065g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
156.145g/mol
Monoisotopic Mass:
156.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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