Chemical Properties of 3(5)-methyl-5(3)-t-butylpyrazole (CAS 96440-80-1)

3(5)-methyl-5(3)-t-butylpyrazole

PDF Excel Molecule Calculator
InChI
InChI=1S/C8H14N2/c1-6-5-7(10-9-6)8(2,3)4/h5H,1-4H3,(H,9,10)
InChI Key
CUJNZTKYZLLKBY-UHFFFAOYSA-N
Formula
C8H14N2
SMILES
Cc1cc(C(C)(C)C)[nH]n1
Molecular Weight1
138.21
CAS
96440-80-1
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
PAff 946.20 kJ/mol NIST
BasG 914.30 kJ/mol NIST
log10WS -2.25 Crippen Calculated Property
logPoct/wat 1.534 Crippen Calculated Property
McVol 124.080 ml/mol McGowan Calculated Property

Similar Compounds

1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-. 3-Amino-5-tert-butylpyrazole. 3(5)-t-butylpyrazole. 1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-4-methyl-. 1-methyl-3,5-di-t-butylpyrazole. 3(5)-ethyl-5(3)-phenylpyrazole. Pyrazole, 3(5)-butyl-5(3)-methyl, 1-acetyl. 7-benz[de]anthrene. 3,5-diethyl-4-methylpyrazole. Kainic acid, N-isoBOC TBDMS. 5-Methyl-2H-pyrazole-3-carboxylic acid, 1-methyl-2-phenylhydrazide. (R)-1,2-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline. Estriol, tris(pentafluoropropionate). 16-Epiestriol, tris(pentafluoropropionate). 5-Methyl-2H-pyrazole-3-carboxylic acid, 2,2-tetramethylene hydrazide.

Find more compounds similar to 3(5)-methyl-5(3)-t-butylpyrazole.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.