1-(2-Bromoethyl)-3-fluorobenzene (HCID 573129)

名称と識別子

優先名称: 1-(2-Bromoethyl)-3-fluorobenzene
IUPAC: 1-(2-bromoethyl)-3-fluorobenzene
現地名: 1-(2-ブロモエチル)-3-フルオロベンゼン
英語名: 3-Fluorophenethyl bromide
分子式: C8H8BrF
分子量: 203.05

名称と別名

1-(2-Bromoethyl)-3-fluorobenzeneRefChem:421646671-146-625017-13-43-Fluorophenethyl Bromide2-(3-fluorophenyl)ethylbromide2-(3-Fluorophenyl)ethyl BromideBenzene, 1-(2-bromoethyl)-3-fluoro-MFCD030953971-Bromo-2-(3-fluorophenyl)ethane1-(2-bromo-ethyl)-3-fluoro-benzene3-fluorophenethylbromide

名称をさらに表示

1-(2-ブロモエチル)-3-フルオロベンゼン1‐（2‐ブロモエチル）‐3‐フルオロベンゼン2-(3-フルオロフェニル)エチルブロミド3-フルオロフェネチルブロミド3-Fluorophenethyl bromide 95%2-(3-Fluorophenyl)ethyl Bromide >1-(2-Bromoethyl)-3-fluorobenzene - [B92653]1-(2-Bromoethyl)-3-fluorobenzene, 1-Bromo-2-(3-fluorophenyl)ethane

3-(2-Bromoethyl)fluorobenzene3-(fluoro)phenethyl bromideSCHEMBL931383SCHEMBL27330484SCHEMBL27780969SCHEMBL28362772SCHEMBL28783487SCHEMBL30186558

データベース識別子

CAS: 25017-13-4
PubChem CID: 573129
DTXSID: DTXSID20341447
EC Number: 671-146-6
Nikkaji: J101.583D

物性

構造計算による物性

XLogP: 3.4
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: 2
重原子数: 10
形式電荷: 0
複雑度: 95

物理化学的性質

沸点: 94 °C · 94 °C / 10mmHg
比重(密度): 1.45 · 1.45
屈折率: 1.533 · 1.5330-1.5360
闪点: 79 ℃ · 79℃
貯蔵温度: Sealed in dry,Room Temperature
外見: clear liquid
色: Colorless to Light yellow
比重: 1.45 · 1.45
InChI: 1S/C8H8BrF/c9-5-4-7-2-1-3-8(10)6-7/h1-3,6H,4-5H2
InChIKey: GLVSPVSJMYQIPJ-UHFFFAOYSA-N
SMILES: Fc1cccc(CCBr)c1
CAS データベース: 25017 · 25017-13-4(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H301 (20%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (60%): Harmful if swallowed [Warning Acute toxicity, oral]；H311 (20%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H312 (40%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (60%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H331 (20%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H332 (40%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (40%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400 (20%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (20%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 3 (20%)；Acute Tox. 4 (60%)；Acute Tox. 3 (20%)；Acute Tox. 4 (40%)；Skin Irrit. 2 (40%)；Eye Irrit. 2A (60%)；Acute Tox. 3 (20%)；Acute Tox. 4 (40%)；STOT SE 3 (40%)；Aquatic Acute 1 (20%)；Aquatic Chronic 1 (20%)