2,6-ジフルオロベンズアミド

2,6-Difluorobenzamide

HCID 87439CAS 18063-03-1

基本情報

標準SMILES
NC(=O)c1c(F)cccc1F
InChIKey
AVRQBXVUUXHRMY-UHFFFAOYSA-N
分子式
C7H5F2NO
平均分子量
157.12 g/mol
単同位体質量
157.03392022

概要

structure given in first source

名称と識別子

優先名称
2,6-Difluorobenzamide
IUPAC
2,6-difluorobenzamide
現地名
2,6-ジフルオロベンズアミド
英語名
2,6-Difluorobenzamide
分子式
C7H5F2NO
分子量
157.12

名称と別名

2,6-Difluorobenzamide18063-03-1Benzamide, 2,6-difluoro-SJ2RN214MKDTXSID4073417RefChem:445557DTXCID6035734241-972-8MFCD000079722,6-difluorobenzoic amideUNII-SJ2RN214MKEC 241-972-8
名称をさらに表示
2,6-ジフルオロベンズアミド2,6-difluorobenzoic acid amideuorobenzamideCompound Fr139742,6-Difluorbenzamid2,6-difluoro-benzamid2,6-difluorobenzaminde2,6-Difluorobenzoamide2,6-Difluorobenzoylamide2,6-Difluorobenzamide97%
CK1202PS-8830SB67309Z1044761382,6-difluoro benzamideEINECS 241-972-8Benzamide, 2,6-difluoro-; 2,6-Difluorobenzamide; Lufenuron Imp. A (EP)2,6 difluorobenzamide

データベース識別子

CAS
18063-03-1
PubChem CID
87439
DTXSID
DTXSID4073417
UNII
SJ2RN214MK
EC Number
241-972-8
Nikkaji
J43.076E

物性

構造計算による物性

XLogP
0.3
極性表面積
43.1 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
1
重原子数
11

実験および物理化学的性質

PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
LogP0.25

物理化学的性質

融点
145 · 145-148 °C (lit.)
沸点
51 · 51-52C/15Tor
比重(密度)
1 · 1,199g/cm
屈折率
1 · 1,508
貯蔵温度
Sealed in dry,Room Temperature
溶解性
5 %、透明~濁り、無色~淡黄色 · エタノール:可溶5%、透明~濁り、無色~淡黄色

化学的性質

化学的特性white to yellowish powder

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 21.5% (56 of 260) of reports.

Warning

H302 (42.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 260 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 4 件

Chemical: Benzamide, 2,6-difluoro-

Commission Regulation No 844/2012

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 13-08-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/5759

Hazard Classes and CategoriesAcute Tox. 4 (42.7%)

安全データ

wgk
1
tsca
TSCA listed
rtecs
CV4355050
毒性
rat,LC50,inhalation,> 2100mg/m3/4H (2100mg/m3),National Technical Information Service. Vol. OTS0543293,
hs_code
29242990
risk_code
36/37/38-20

化学と産業

用途と製造

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
General Manufacturing InformationBenzamide, 2,6-difluoro-: ACTIVE
応用分野 · 3 件

説明2,6-Difluorobenzamide is a major metabolite of pesticide diflubenzuron and has been quantitated by HPLC/diode-array method.

説明2,6-Difluorobenzamide is a white powdery crystal, insoluble in water. It can be obtained by hydrolysis of 2,6-difluorobenzonitrile. 2,6-Difluorobenzamide is an important intermediate in the synthesis process of benzoylurea insecticides, which is used to synthesize the next intermediate 2,6-difluorobenzoyl isocyanate, and finally obtain flubolurea, pyruron, fluridin, lice mite urea and other pesticide varieties. It can also be directly used to synthesize pyruron and flubolea. 2,6-Difluorobenzamide can inhibit the bacterial cell division protein FtsZ[1].

使用2,6-Difluorobenzamide (CAS# 18063-03-1) is a useful building block used in the synthesis of (E)-3-methyleneisoindolin-1-ones via oxidative annulation acrylates. It is also used in the synthesis of pesticide intermediates, which can be used to produce various insecticides such as fluazuron, chlorpyrifos, and pyrethroids.

調製方法

製造方法2,6-Difluorobenzamide is obtained by hydrolysis of 2,6-difluorobenzonitrile.

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海恩氟佳科技有限公司15800445152 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

関連反応

62 件

関連ノート

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2,6-Difluorobenzamide (HCID 87439)|化工社