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88279-25-8 | Urea, 2H-indazol-2-yl-
CAS No: 88279-25-8 Catalog No: AG004BHN MDL No:
Product Description
Catalog Number:
AG004BHN
Chemical Name:
Urea, 2H-indazol-2-yl-
CAS Number:
88279-25-8
Molecular Formula:
C8H8N4O
Molecular Weight:
176.1753
IUPAC Name:
indazol-2-ylurea
InChI:
InChI=1S/C8H8N4O/c9-8(13)11-12-5-6-3-1-2-4-7(6)10-12/h1-5H,(H3,9,11,13)
InChI Key:
OQELQSOGOBSJCN-UHFFFAOYSA-N
SMILES:
NC(=O)Nn1cc2c(n1)cccc2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.179g/mol
Monoisotopic Mass:
176.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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