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287922-73-0 | 1H-Pyrazole-3-carboximidamide, 4-bromo-N-hydroxy-1-methyl-
CAS No: 287922-73-0 Catalog No: AG002WI6 MDL No:
Product Description
Catalog Number:
AG002WI6
Chemical Name:
1H-Pyrazole-3-carboximidamide, 4-bromo-N-hydroxy-1-methyl-
CAS Number:
287922-73-0
Molecular Formula:
C5H7BrN4O
Molecular Weight:
219.0393
IUPAC Name:
4-bromo-N'-hydroxy-1-methylpyrazole-3-carboximidamide
InChI:
InChI=1S/C5H7BrN4O/c1-10-2-3(6)4(8-10)5(7)9-11/h2,11H,1H3,(H2,7,9)
InChI Key:
BTHNJNKFWJQYTO-UHFFFAOYSA-N
SMILES:
Cn1cc(c(n1)C(=N)NO)Br
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
217.98g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.042g/mol
Monoisotopic Mass:
217.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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