5-Ethynyl-3-methyl-1H-indazole


Chemical Name: 5-Ethynyl-3-methyl-1H-indazole
CAS Number: 1093307-29-9
Product Number: AG0082JZ(AGN-PC-0WABDN)
Synonyms:
MDL No:
Molecular Formula: C10H8N2
Molecular Weight: 156.1839

Identification/Properties


Computed Properties
Molecular Weight:
156.188g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
156.069g/mol
Monoisotopic Mass:
156.069g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
215
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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