(2-Bromoethyl)cyclohexane (HCID 15440)

名称と識別子

優先名称: (2-Bromoethyl)cyclohexane
IUPAC: 2-bromoethylcyclohexane
現地名: (2-ブロモエチル)シクロヘキサン
英語名: 2-Cyclohexylethyl bromide
分子式: C8H15Br
分子量: 191.11

名称と別名

(2-Bromoethyl)cyclohexane2-Cyclohexylethyl bromideCyclohexane, (2-bromoethyl)-DTXSID9075111AI3-17379NSC 6078EINECS 216-712-1NSC 46808RefChem:68575DTXCID5035290216-712-1JRQAAYVLPPGEHT-UHFFFAOYSA-N

名称をさらに表示

2-ブロモエチルシクロヘキサン2-シクロヘキシルエチルブロミド(2-ブロモエチル)シクロヘキサン1-ブロモ-2-シクロヘキシルエタン(2-ブロモエチル)シクロヘキサン, 99%(2-bromoethyl)-cyclohexanecyclohexane,(2-bromoethyl)-2-Cyclohexylethyl bromide,98%1-Bromo-2-cyclohexylethane 98%2-CYCLOHEXYLETHYL BROMIDE ISO 9001：2015 REACH

1647-26-31-BROMO-2-CYCLOHEXYLETHANE2-bromoethylcyclohexane2-CyclohexylethylbromideMFCD00019398Bromoethyl cyclohexaneUNII-FJ47VAQ8KW1-bromo-2cyclohexylethane

データベース識別子

CAS: 1647-26-3
PubChem CID: 15440
DTXSID: DTXSID9075111
UNII: FJ47VAQ8KW
EC Number: 216-712-1
Nikkaji: J44.134A

物性

構造計算による物性

XLogP: 4.1
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 2
重原子数: 9
形式電荷: 0
複雑度: 65

物理化学的性質

融点: 57 °C · 57°C
沸点: 209 °C · 209 °C (lit.)
比重(密度): 1.221 g/mL · 1.221 g/mL at 25 °C (lit.)
屈折率: 1.49 · 1.4900
闪点: 96 °C · 96°C
貯蔵温度: Inert atmosphere,Room Temperature
溶解性: クロロホルム（少量）、酢酸エチル（少量）
外見: 液体
色: 無色透明～微黄色透明
BRN: 1919816 · 1919816
安定性: 安定。可燃性。強力な酸化剤とは相容れない。
InChI: 1S/C8H15Br/c9-7-6-8-4-2-1-3-5-8/h8H,1-7H2
InChIKey: JRQAAYVLPPGEHT-UHFFFAOYSA-N
SMILES: BrCCC1CCCCC1
CAS データベース: 1647 · 1647-26-3(CAS DataBase Reference)
EPAの化学物質情報: Cyclohexane, (2-bromoethyl)- (1647-26-3)

化学的性質

化学的特性2-CYCLOHEXYLETHYL BROMIDE is colourless to yellow liquid

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 (33.3%): 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.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (33.3%)

安全データ

wgk: 3
hs_code: 29021900
risk_code: 36/38
safety_code: 26-36
ストレージクラス: 10 - Combustible liquids

化学と産業

応用分野 · 2 件

使用2-CYCLOHEXYLETHYL BROMIDE is a reagent used in the cross-coupling and Grignard reactions. It is used in the synthesis of immunosuppressive agents consisting of 5-phenylalkoxypsoralens as well as agon ists for human vitamin-D resistant Rickets.

一般的な説明1-Bromo-2-cyclohexylethane is a halogenated hydrocarbon. Reaction of 1-bromo-2-cyclohexylethane with pillar[5]arene has been investigated.