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1440535-43-2 | 4-(1-Methyl-1H-indazol-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
CAS No: 1440535-43-2 Catalog No: AG01FGIQ MDL No:
Product Description
Catalog Number:
AG01FGIQ
Chemical Name:
4-(1-Methyl-1H-indazol-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
CAS Number:
1440535-43-2
IUPAC Name:
4-(1-methylindazol-3-yl)-1H-1,2,4-triazol-5-one
InChI:
InChI=1S/C10H9N5O/c1-14-8-5-3-2-4-7(8)9(13-14)15-6-11-12-10(15)16/h2-6H,1H3,(H,12,16)
InChI Key:
PIMZKEPSQHBGRR-UHFFFAOYSA-N
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.081g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.216g/mol
Monoisotopic Mass:
215.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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