Chemical Properties of 1-benzylpyrazole

InChI

InChI=1S/C10H10N2/c1-2-5-10(6-3-1)9-12-8-4-7-11-12/h1-8H,9H2

InChI Key

AKQAJYLKBCWJBV-UHFFFAOYSA-N

Formula

C10H10N2

SMILES

c1ccc(Cn2cccn2)cc1

Molecular Weight¹

158.20

Other Names

• 1-(phenylmethyl)-1H-pyrazole
• 1-benzyl-1H-pyrazole
• 1H-pyrazole, 1-(phenylmethyl)-
• N-benzylpyrazole
• pyrazole, 1-benzyl-

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_vap : Vapor pressure (kPa).
• T_boil : Boiling point at given pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.47e-03; 0.16]	kPa	[298.20; 358.20]
Pvap	1.47e-03	kPa	298.20	Benchma...
Pvap	4.30e-03	kPa	310.20	Benchma...
Pvap	6.15e-03	kPa	314.20	Benchma...
Pvap	8.82e-03	kPa	318.20	Benchma...
Pvap	0.01	kPa	322.20	Benchma...
Pvap	0.02	kPa	326.20	Benchma...
Pvap	0.02	kPa	326.20	Benchma...
Pvap	0.02	kPa	330.20	Benchma...
Pvap	0.03	kPa	334.20	Benchma...
Pvap	0.04	kPa	338.20	Benchma...
Pvap	0.06	kPa	342.20	Benchma...
Pvap	0.07	kPa	346.20	Benchma...
Pvap	0.10	kPa	350.20	Benchma...
Pvap	0.12	kPa	354.20	Benchma...
Pvap	0.16	kPa	358.20	Benchma...

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to 1-benzylpyrazole.

Sources

• Crippen Method
• Crippen Method
• Benchmark properties of pyrazole derivatives as a potential liquid organic hydrogen carrier: Evaluation of thermochemical data with complementary experimental and computational methods
• McGowan Method

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