1. Home
  2. 1H-1,2,4-Triazole, 3-(1,1-dimethylethyl)-

Contact Angene

Tel: +852 8191 6999

Email: [email protected]

Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1H-1,2,4-Triazole, 3-(1,1-dimethylethyl)-

CC(c1n[nH]cn1)(C)C Request for Quotation
Chemical Name: 1H-1,2,4-Triazole, 3-(1,1-dimethylethyl)-
CAS Number: 96440-78-7
Product Number: AG006QRQ(AGN-PC-0OODO7)
Synonyms:
MDL No:
Molecular Formula: C6H11N3
Molecular Weight: 125.1716

Identification/Properties

Properties
BP:
238.1±23.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Computed Properties
Molecular Weight:
125.175g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
125.095g/mol
Monoisotopic Mass:
125.095g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
95
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

Request for Quotation

Customer Feedback

Chemical Structure


3-(tert-Butyl)-1H-1,2,4-triazole plays a crucial role in chemical synthesis as a versatile building block. It is commonly utilized as a stabilizer for peroxides and various reactive intermediates due to its unique structural properties. Additionally, this compound serves as a valuable precursor in the preparation of pharmaceuticals, agrochemicals, and materials science. Its presence in synthesis reactions often leads to efficient processes and high yields, making it a valuable tool for synthetic chemists in various industries.