1-Pivaloyl-1,2,4-triazole

2,2-dimethyl-1-(1,2,4-triazol-1-yl)propan-1-one

CAS: 60718-52-7

Molecular Formula	`C7H11N3O`
Molecular Weight	153.18 g/mol
LogP	1.3
Topological Polar Surface Area	47.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	153.09021
Heavy Atoms	11
Complexity	162.0

Chemical Identifiers

CAS Number	60718-52-7
SMILES	`CC(C)(C)C(=O)N1C=NC=N1`
InChIKey	`UJTIGDOKKYGPSB-UHFFFAOYSA-N`

📖 Product Overview

1-Pivaloyl-1,2,4-triazole (CAS: 60718-52-7) is a chemical compound with molecular formula C7H11N3O and molecular weight 153.18 g/mol. Its IUPAC systematic name is 2,2-dimethyl-1-(1,2,4-triazol-1-yl)propan-1-one. LogP 1.3 Topological Polar Surface Area 47.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 1 Exact Mass 153.09021 Heavy Atoms 11 Complexity 162.0 InChI Key: UJTIGDOKKYGPSB-UHFFFAOYSA-N. SMILES: CC(C)(C)C(=O)N1C=NC=N1.

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