1-ブロモ-2,5-ジクロロ-3-フルオロベンゼン

1-Bromo-2,5-dichloro-3-fluorobenzene

HCID 618513

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 202865-57-4
標準SMILES: Fc1cc(Cl)cc(Br)c1Cl
InChIKey: CAYJMDVKWMVOLG-UHFFFAOYSA-N
分子式: C6H2BrCl2F
平均分子量: 243.88 g/mol
単同位体質量: 241.8701

名称と識別子

優先名称: 1-Bromo-2,5-dichloro-3-fluorobenzene
IUPAC: 1-bromo-2,5-dichloro-3-fluorobenzene
現地名: 1-ブロモ-2,5-ジクロロ-3-フルオロベンゼン
英語名: 1-BROMO-2,5-DICHLORO-3-FLUOROBENZENE
分子式: C6H2BrCl2F
分子量: 243.89

名称と別名

1-Bromo-2,5-dichloro-3-fluorobenzene202865-57-4DTXSID60347160RefChem:75045DTXCID90298232606-489-2MFCD001425852,5-dichloro-3-fluorobromobenzeneBenzene, 1-bromo-2,5-dichloro-3-fluoro-3-bromo-2,5-dichloro-1-fluorobenzene1-bromo-2,5-dichloro-3-fluoro-benzeneSCHEMBL263907

名称をさらに表示

1-ブロモ-2,5-ジクロロ-3-フルオロベンゼン1‐ブロモ‐2,5‐ジクロロ‐3‐フルオロベンゼン1-ブロモ-2,5-ジクロロ-3-フルオロベンゼン, 97%2,5-dichloro-3-fluoro-1-bromobenzene1-Bromo-2,5-dichloro-3-fluorobenzene98%1-Bromo-2,5-dichloro-3-fluorobenzene 98%

CK2374AKOS005255314CS-W012751BP-11122SY0465281-Bromo-2,5-dichloro-3-fluorobenzene #A814382SCHEMBL29363756

データベース識別子

CAS: 202865-57-4
PubChem CID: 618513
DTXSID: DTXSID60347160
EC Number: 606-489-2
Nikkaji: J2.343.835F

物性

構造計算による物性

XLogP: 4
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: 0
重原子数: 10
形式電荷: 0
複雑度: 122

物理化学的性質

沸点: 232 ℃ · 232℃
比重(密度): 1.823 · 1.823
屈折率: 1.5745 · 1.5745-1.5765
闪点: 94 ℃ · 94℃
貯蔵温度: Sealed in dry,Room Temperature
外見: liquid
色: Clear, colourless
InChI: InChI=1S/C6H2BrCl2F/c7-4-1-3(8)2-5(10)6(4)9/h1-2H
InChIKey: CAYJMDVKWMVOLG-UHFFFAOYSA-N
SMILES: C1(Br)=CC(Cl)=CC(F)=C1Cl
CAS データベース: 202865 · 202865-57-4(CAS DataBase Reference)

化学的性質

化学的特性Clear colourless to light yellow liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (18.2%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (18.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (81.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+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 11 reports by companies from 5 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.