3-(1H-Pyrazol-1-yl)propane-1,2-diol


Chemical Name: 3-(1H-Pyrazol-1-yl)propane-1,2-diol
CAS Number: 98484-49-2
Product Number: AG00IK3V(AGN-PC-0WAMD7)
Synonyms:
MDL No: MFCD11846459
Molecular Formula: C6H10N2O2
Molecular Weight: 142.1558

Identification/Properties


Computed Properties
Molecular Weight:
142.158g/mol
XLogP3:
-1.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
142.074g/mol
Monoisotopic Mass:
142.074g/mol
Topological Polar Surface Area:
58.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
99.7
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



3-(1H-Pyrazol-1-yl)propane-1,2-diol is a versatile compound widely utilized in chemical synthesis due to its unique structure and reactivity. This compound serves as a valuable building block in organic chemistry, particularly in the synthesis of pharmaceuticals, agrochemicals, and fine chemicals. One key application of 3-(1H-Pyrazol-1-yl)propane-1,2-diol is its use as a linker in the construction of complex molecular structures. Its reactive hydroxyl groups can undergo a variety of chemical transformations, including esterification, acylation, and alkylation, enabling the attachment of different functional groups to tailor the properties of the final product. Additionally, the presence of the pyrazole ring in the molecule enhances its biological activity, making it particularly desirable in the design and synthesis of bioactive compounds. Furthermore, 3-(1H-Pyrazol-1-yl)propane-1,2-diol can participate in multicomponent reactions, providing a convenient route to access diverse compound libraries for drug discovery and materials science.