1,2-Dibenzoyl-1-(tert-butyl)hydrazine

HCID 86307

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Basic information

CAS: 112225-87-3
Standard SMILES: CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c1ccccc1
InChIKey: NISLLQUWIJASOV-UHFFFAOYSA-N
Molecular formula: C18H20N2O2
Average molar mass: 296.4 g/mol
Monoisotopic mass: 296.15247788

Overview

N'-benzoyl-N-(tert-butyl)benzohydrazide is a bisacylhydrazine insecticide. It is functionally related to a 1,2-dibenzoylhydrazine.

Names & identifiers

Preferred name: 1,2-Dibenzoyl-1-(tert-butyl)hydrazine
IUPAC: N'-benzoyl-N'-tert-butylbenzohydrazide
English name: 1,2-DIBENZOYL-1-(T-BUTYL)HYDRAZINE
Molecular formula: C18H20N2O2
Molecular weight: 296.36

Names & synonyms

112225-87-31,2-Dibenzoyl-1-tert-butylhydrazineN'-benzoyl-N-tert-butylbenzohydrazideLA6UVC88VDBenzoic acid, 2-benzoyl-1-(1,1-dimethylethyl)hydrazide1,2-Dibenzoyl-1-(tert-butyl)hydrazine1,2-dibenzoyl-tert-butylhydrazine1,2-DIBENZOYL-T-BUTYLHYDRAZINEDTXSID7073800RH-05849-2FRefChem:411530DTXCID1033292

Show more names

RH5849KH5849RH 5849-2FC16813000 RH 5849Food Inhibitor TCRH-5849 (Standard)RH-5849, 10 mM in DMSO2-Dibenzoyl-1-(T-Butyl)Hydrazine2-Dibenzoyl-1-Tert-Butylhydrazine

RH-58491,2-Dibenzoyl-1-(t-butyl)hydrazineRH 5849YishijingN'-benzoyl-N'-tert-butylbenzohydrazideN'-benzoyl-N-(tert-butyl)benzohydrazideN'-benzoyl-N-(tert-butyl)benzenecarbohydrazideMFCD00940249

Database identifiers

CAS: 112225-87-3
PubChem CID: 86307
DTXSID: DTXSID7073800
ChEMBL: CHEMBL387744
ChEBI: CHEBI:38457
UNII: LA6UVC88VD
EC Number: 881-743-5
Nikkaji: J381.714H

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 49.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 22
Formal charge: 0
Complexity: 388

Experimental & physicochemical properties

LogP2.45

Physicochemical properties

Melting point: 178.5 °C · 178.5 °C
Density: 1.128 · 1.128±0.06 g/cm3(Predicted)
pka: 10.97 · 10.97±0.46(Predicted)
form: Solid
color: White to off-white
FDA UNII: 6 UVC88VD · LA6UVC88VD
EPA Substance Registry System: 1 · 1,2-Dibenzoyl-1-tert-butylhydrazine (112225-87-3)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302
Precautionary statements: P264-P270-P301+P312-P330-P501

Chemistry & industry

Applications

Uses1,2-Dibenzoyl-1-(tert-butyl)hydrazine is an ecdysone agonist that causes the premature initiation of molting at all stages of larval development of the tobacco hornworm, Manduca sexta.

Suppliers71 total

陕西科贝莱药物研发有限公司13119135307 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北博杰生物科技有限公司0713-2060728 15629612610

湖北万得化工有限公司15377098680 15377098680 · [email protected]

重庆欣博曜生物科技有限公司19122915778 · [email protected]

Additional notes

DefinitionChEBI: N'-benzoyl-N-(tert-butyl)benzohydrazide is a bisacylhydrazine insecticide. It is functionally related to a 1,2-dibenzoylhydrazine.