CHEBI:34590 - bromobutide

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ChEBI Name bromobutide
ChEBI ID CHEBI:34590
Definition A monocarboxylic acid amide having a 2-phenylpropan-2-yl substituent attached to the amide nitrogen and a 1-bromo-2,2-dimethylpropyl group attached to the carbonyl carbon.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H22BrNO
Net Charge 0
Average Mass 312.24500
Monoisotopic Mass 311.08848
InChI InChI=1S/C15H22BrNO/c1-14(2,3)12(16)13(18)17-15(4,5)11-9-7-6-8-10-11/h6-10,12H,1-5H3,(H,17,18)
InChIKey WZDDLAZXUYIVMU-UHFFFAOYSA-N
SMILES CC(C)(C)C(Br)C(=O)NC(C)(C)c1ccccc1
Roles Classification
Application(s): herbicide
A substance used to destroy plant pests.
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ChEBI Ontology
Outgoing bromobutide (CHEBI:34590) has role herbicide (CHEBI:24527)
bromobutide (CHEBI:34590) is a monocarboxylic acid amide (CHEBI:29347)
bromobutide (CHEBI:34590) is a organobromine compound (CHEBI:37141)
IUPAC Name
2-bromo-3,3-dimethyl-N-(2-phenylpropan-2-yl)butanamide
Synonyms Sources
(RS)-2-Bromo-N-(alpha,alpha-dimethylbenzyl)-3,3-dimethylbutyramide KEGG COMPOUND
2-Bromo-3,3-dimethyl-N-(1-methyl-1-phenylethyl)butanamide KEGG COMPOUND
2-Bromo-3,3-dimethyl-N-N-(alpha-alpha-dimethylbenzyl)butyramide ChemIDplus
Bromobutide KEGG COMPOUND
S 47 (pesticide) ChemIDplus
S-4347 ChemIDplus
Sumiherb KEGG COMPOUND
Manual Xrefs Databases
1372 PPDB
C14568 KEGG COMPOUND
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Registry Numbers Types Sources
6861914 Beilstein Registry Number Beilstein
74712-19-9 CAS Registry Number NIST Chemistry WebBook
74712-19-9 CAS Registry Number ChemIDplus
Last Modified
28 July 2014