3-tert-Butyl-1H-pyrazole

• Catalog Number: ACM15802809
• Product Name: 3-tert-Butyl-1H-pyrazole
• CAS: 15802-80-9
• Category: Heterocyclic Organic Compound
• Synonyms: 3(5)-t-Butylpyrazole, 3-tert-butyl-1H-pyrazole, Bionet2_000181, MolPort-002-344-063, MolPort-003-922-580, ZINC04002959, HMS1364I05, ALBB-005414, CID139978, STK503396, 3B-013, 15802-80-9, InChI=1/C7H12N2/c1-7(2,3)6-4-5-8-9-6/h4-5H,1-3H3,(H,8,9
• IUPAC Name: 5-tert-butyl-1H-pyrazole
• Molecular Weight: 124.19
• Molecular Formula: C₇H₁₂N₂
• Canonical SMILES: CC(C)(C)C1=CC=NN1
• InChI Key: YIDCITOHTLPMMZ-UHFFFAOYSA-N
• Boiling Point: 219.1ºC at 760 mmHg
• Flash Point: 87.9ºC
• Density: 0.972g/cm³
• Exact Mass: 124.10000
• H-Bond Acceptor: 1
• H-Bond Donor: 1