5-(2-METHYLPHENYL)-1H-TETRAZOLE

• CAS: 51449-86-6
• Catalog Number: ACM51449866
• Category: Other Products
• Molecular Weight: 160.18
• Molecular Formula: C8H8N4
• Synonyms: ZINC02786193, ZINC12360034, CID2171496, 51449-86-6
• IUPAC Name: 1-(2-methylphenyl)-2,3,4-triaza-5-azanidacyclopenta-1,3-diene
• Canonical SMILES: CC1=CC=CC=C1C2=NNN=N2
• InChI Key: WXCHXJGVYSYFLZ-UHFFFAOYSA-N
• Boiling Point: 343ºC at 760mmHg
• Melting Point: 151-154ºC
• Flash Point: 164.4ºC
• Density: 1.241g/cm³
• Exact Mass: 160.07500
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Safety Description: S26-S36

Synthetic Use

Upstream Synthesis Route 1

• 529-19-1

• 51449-86-6

Reference: [1]Molecules,2015,vol. 20,p. 22757 - 22766

Upstream Synthesis Route 2

• 18039-42-4
• 74-88-4

• 51449-86-6

Reference: [1]Tetrahedron Letters,2002,vol. 43,p. 3137 - 3139
[2]Tetrahedron Letters,1991,vol. 32,p. 6857 - 6860
[3]Tetrahedron Letters,1991,vol. 32,p. 6857 - 6860

Downstream Synthesis Route 1

• 51449-86-6
• 628-17-1

• 138944-19-1

Reference: [1]Tetrahedron Letters,1991,vol. 32,p. 6857 - 6860

* For details of the synthesis route, please refer to the original source to ensure accuracy.