58010-98-3
4-(2,4-dichlorobenzoyl)-2,5-dimethyl-1H-pyrazol-3-one
Molecular Identity
58010-98-3
4-(2,4-dichlorobenzoyl)-2,5-dimethyl-1H-pyrazol-3-one
PubChem CID: 119498
Destosyl pyrazolate is a member of the class of pyrazoles that is pyrazolynate in which the tosylate ester has been hydrolysed to the corresponding hydroxy compound. The active herbicide of the proherbicides pyrazolynate and pyrazoxyfen. It has a role as a carotenoid biosynthesis inhibitor, a herbicide, an agrochemical and an EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor. It is a member of acetophenones, a dichlorobenzene, a member of pyrazoles, an organic hydroxy compound and a pyrazole pesticide.
2D Structure
Properties
C12H10Cl2N2O2
Molecular Formula
285.12
Molecular Weight
g/mol
284.0119
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
49.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
422
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
58010-98-34-(2,4-dichlorobenzoyl)-1,3-dimethyl-5-hydroxypyrazole(2,4-Dichlorophenyl)(5-hydroxy-1,3-dimethyl-1H-pyrazol-4-yl)methanoneDTPMethanone, (2,4-dichlorophenyl)(5-hydroxy-1,3-dimethyl-1H-pyrazol-4-yl)-1,3-Dimethyl-4-(2,4-dichlorobenzoyl)-5-hydroxypyrazoleDestosyl pyrazolate4-(2,4-dichlorobenzoyl)-2,5-dimethyl-1H-pyrazol-3-one4-(2,4-dichlorobenzoyl)-2,5-dimethyl-1,2-dihydro-3h-pyrazol-3-oneCHEBI:4302SCHEMBL13244744-(2,4-Dichlorobenzoyl)-1,3-dimethyl-1H-pyrazol-5-ol1,3-dimethyl-4-(2,4-dichlorobenzoyl)-1H-pyrazole-5-olDTXSID00973583XMSHRLOQLUNKSN-UHFFFAOYSA-N
Data from PubChem (NCBI)
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