4-氯-2-氟-N-乙酰基苯胺

4'-Chloro-2'-fluoroacetanilide

HCID 853174CAS 59280-70-5

子结构检索查找相似结构

基本信息

标准SMILES: CC(=O)Nc1ccc(Cl)cc1F
InChIKey: GVRKNSAEOVXHOS-UHFFFAOYSA-N
分子式: C8H7ClFNO
平均分子量: 187.6 g/mol
单同位素质量: 187.02001974

名称与标识

首选名称: 4'-Chloro-2'-fluoroacetanilide
IUPAC: N-(4-chloro-2-fluorophenyl)acetamide
中文名: 4-氯-2-氟-N-乙酰基苯胺
英文名: 4'-Chloro-2'-fluoroacetanilide
分子式: C8H7ClFNO
分子量: 187.6

名称与别名

4'-Chloro-2'-fluoroacetanilide59280-70-5N-(4-chloro-2-fluorophenyl)acetamideDTXSID40357409RefChem:506032DTXCID10308468676-577-34-CHLORO-2-FLUOROACETANILIDEMFCD00042520Acetamide, N-(4-chloro-2-fluorophenyl)-4-chloro2-fluoroacetanilide4'--Chloro-2'-fluoroacetanilide

展开更多名称

2-氟-4-氯乙酰苯胺4-氯-2-氟乙酰苯胺4'-氯-2-氟乙酰苯胺4'-氯-2'-氟乙酰苯胺2-氟-4-氯-N-乙酰苯胺4-氯-2-氟-N-乙酰基苯胺N-乙酰基-4-氯-2-氟苯胺4'-氯-2'-氟乙酰苯胺*5N-(4-氯-2-氟苯基)乙酰胺4'-氯-2'-氟乙酰苯胺,98%TIMTEC-BB SBB0036844'-Chloro-2'-fluoroacetanilide98%4'-Chloro-2'-fluoroacetanilide >4'-Chloro-2'-fluoroacetanilide 98%4'-CHLORO-2'-FLUOROACETANILIDE , 99+%

2'-Fluoro-4'-chloroacetaniliden-(4-chloro-2-fluorophenyl)4'-chloro-2'-fluroacetanilideSCHEMBL3873599SCHEMBL27693345SCHEMBL296830634'-chloro-2 '-fluoroacetanilide4'-chloro-2' -fluoroacetanilide

数据库标识

CAS: 59280-70-5
PubChem CID: 853174
DTXSID: DTXSID40357409
EC Number: 676-577-3
Nikkaji: J267.379G

性质

结构计算性质

XLogP: 1.9
极性表面积: 29.1 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 1
重原子: 12
形式电荷: 0
复杂度: 176

物理化学性质

熔点: 154 · 154-156 °C(lit.)
沸点: 312.8 · 312.8±32.0 °C(Predicted)
密度: 1.302 · 1.3020 (estimate)
储存条件: Sealed in dry,Room Temperature
酸度系数(pKa): 13.16 · 13.16±0.70(Predicted)
形态: powder to crystal
颜色: White to Light yellow to Light red
BRN: 2092371 · 2092371
CAS 数据库: 59280 · 59280-70-5(CAS DataBase Reference)

安全与法规

GHS分类

GHS Classification · 4 条

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危害信息

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全数据

wgk: 3
危险等级: IRRITANT
安全说明: 45-36/37/39-36-26
海关编码: 29214200
危险品标志: T,Xi
危险类别码: 23/24/25-36/37/38

化学与工业

应用领域

用途用作精细化工中间体

上下游产品信息

下游产品

4-氯-2-氟苯胺

试剂价格

C1692 · 5G: 4'-氯-2'-氟乙酰苯胺4'-Chloro-2'-fluoroacetanilide — 30元
XW025928070503 · 100g: N-(4-氯-2-氟苯基)乙酰胺N-(4-Chloro-2-fluorophenyl)acetamide — 564元