2-(4-フルオロフェニル)エチルクロリド

1-(2-Chloroethyl)-4-fluorobenzene

HCID 67622CAS 332-43-4

部分構造検索類似構造を探す

基本情報

標準SMILES: Fc1ccc(CCCl)cc1
InChIKey: LPUURRVXQCVXCX-UHFFFAOYSA-N
分子式: C8H8ClF
平均分子量: 158.6 g/mol
単同位体質量: 158.0298561

名称と識別子

優先名称: 1-(2-Chloroethyl)-4-fluorobenzene
IUPAC: 1-(2-chloroethyl)-4-fluorobenzene
現地名: 2-(4-フルオロフェニル)エチルクロリド
英語名: 1-(2-CHLOROETHYL)-4-FLUOROBENZENE
分子式: C8H8ClF
分子量: 158.6

名称と別名

1-(2-Chloroethyl)-4-fluorobenzene332-43-4EINECS 206-364-9DTXSID30186846RefChem:74115DTXCID70109337206-364-94-Fluorophenethyl Chloride2-(4-Fluorophenyl)ethyl ChlorideMFCD001550001-(2'-Chloroethyl)-4-fluorobenzene1-(2-Chloroethyl)-4-fluoro-benzene

名称をさらに表示

2-(4-フルオロフェニル)エチルクロリド1-(2-クロロエチル)-4-フルオロベンゼン1-(2-クロロエチル)-4-フルオロベンゼン塩化物1-クロロ-2-(4-フルオロフェニル)エタン4-フルオロフェネチルクロリド1-(2'-クロロエチル)-4-フルオロベンゼン4-FLUOROPHENETYL CHLORIDE1-CHLORO-2-(4-FLUOROPHENYL)ETHANE2-(4-Fluorophenyl)ethylChloride>2-(4-FLUOROPHENYL)ETHYL CHLORIDE EP1-(2-Chloroethyl)-4-fluorobenzene97%1-(2-Chloroethyl)-4-fluorobenzene 97%1-(2-Chloroethyl)-4-fluorobenzene - [C92707]

Benzene, 1-(2-chloroethyl)-4-fluoro-p-Fluorophenethyl Chloride; 1-(2-Chloroethyl)-4-fluorobenzene1-(2-Chloro-ethyl)-4-fluoro-benzeneSCHEMBL990098SCHEMBL279757011-(-Chloroethyl)-4-fluorobenzene1-fluoro-4-(2-chloroethyl)benzene4-(2-chloroethyl)-1-fluorobenzene

データベース識別子

CAS: 332-43-4
PubChem CID: 67622
DTXSID: DTXSID30186846
EC Number: 206-364-9
Nikkaji: J193.763D

物性

構造計算による物性

XLogP: 2.9
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 2
重原子数: 10
形式電荷: 0
複雑度: 87

物理化学的性質

沸点: 89 °C · 89 °C
比重(密度): 1 · 1,507 g/cm3
屈折率: 1.507 · 1.507
闪点: 98 · 98-99°C/26mm
貯蔵温度: Refrigerator
溶解性: ベンゼン、メタノール（微量）
外見: 油
色: 無色
BRN: 2079481 · 2079481
InChI: 1S/C8H8ClF/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6H2
InChIKey: LPUURRVXQCVXCX-UHFFFAOYSA-N
SMILES: ClCCC1=CC=C(F)C=C1
CAS データベース: 332 · 332-43-4(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (16.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.