Thifensulfuron

HCID 178941491CAS 79227-67-1

基本情報

標準SMILES: COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccsc2C(=O)O)n1
InChIKey: LOQQVLXUKHKNIA-UHFFFAOYSA-N
分子式: C11H11N5O6S2
平均分子量: 373.4 g/mol

概要

Thifensulfuron is an N-sulfonylurea in which the sulfur atom is attached to a 2-carboxythiophen-3-yl group and in which the non-sulfonated nitrogen is substituted by a 4-methoxy-6-methyl-1,3,5-triazin-2-yl group. The corresponding methyl ester, known as thifensulfuron-methyl, is used as a post-emergence herbicide for the control of grass and broad-leaved weeds. It has a role as a herbicide and an agrochemical. It is a member of 1,3,5-triazines, a thiophenecarboxylic acid and a N-sulfonylurea.

名称と識別子

優先名称: Thifensulfuron
IUPAC: 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid
英語名: THIFENSULFURON
分子式: C11H11N5O6S2
分子量: 373.369

名称と別名

Thifensulfuron79277-67-1thiameturonThifensulfuron [ISO]thifensulfuron acidUNII-R1O5RY2GKCR1O5RY2GKCDTXSID1058185CHEBI:1320533-(4-methoxy-6-methyl-1,3,5-triazin-2-ylcarbamoylsulfamoyl)thiophene-2-carboxylic acid3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid3-(((4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl)sulfamoyl)thiophene-2-carboxylic acid

名称をさらに表示

TRYLEAD TL80066813-(4-METHOXY-6-METHYL-1-3,5-TRIAZIN-2-YLCARBAMOYLSULFAMOYL)THIOPHEN-2-CARBOXYLIC ACID

RefChem:189393DTXCID7031953Thifensulfuron (free acid)79227-67-13-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid2-Thiophenecarboxylic acid, 3-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-3-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-2-thiophenecarboxylic acid2-Thiophenecarboxylic acid, 3-(((((4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino)carbonyl)amino)sulfonyl)-

データベース識別子

CAS: 79227-67-1
ChEBI: CHEBI:132053
UNII: R1O5RY2GKC
EC Number: 616-675-5
Nikkaji: J372.961C

物性

構造計算による物性

XLogP: 1.2
極性表面積: 197 Å²
水素結合供与体数: 3
水素結合受容体数: 10
回転可能結合数: 5
重原子数: 24
形式電荷: 0
複雑度: 582

実験および物理化学的性質

PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P273, P280, P305+P351+P338, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 29 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesEye Irrit. 2 (100%)

化学と産業

用途と製造

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)