ブロモシクロプロパン

Bromocyclopropane

HCID 78037CAS 4333-56-6

基本情報

標準SMILES
BrC1CC1
InChIKey
LKXYJYDRLBPHRS-UHFFFAOYSA-N
分子式
C3H5Br
平均分子量
120.98 g/mol
単同位体質量
119.95746226

名称と識別子

優先名称
Bromocyclopropane
IUPAC
bromocyclopropane
現地名
ブロモシクロプロパン
英語名
Cyclopropyl bromide
分子式
C3H5Br
分子量
120.98

名称と別名

BromocyclopropaneCyclopropyl bromide4333-56-6Cyclopropane, bromo-cyclopropylbromide1-bromocyclopropaneMFCD00001271bromo-cyclopropaneCyclopropyl bromide; NSC 89692cyclopropylbrornideNSC89692EINECS 224-375-7
名称をさらに表示
ブロモシクロプロパン1-ブロモシクロプロパンシクロプロピルブロミドシクロプロピルブロマイド臭化シクロプロピルCyclopropylCyclopropyl bromineBromocycLbromo-cyclopropanBromocyclopropane>
NSC 89692Bromocyclopropane, 99%SCHEMBL265179SCHEMBL456607SCHEMBL1411737SCHEMBL8036160DTXSID8063418SCHEMBL12499777

データベース識別子

CAS
4333-56-6
PubChem CID
78037
DTXSID
DTXSID8063418
EC Number
224-375-7
Nikkaji
J150.689G

物性

構造計算による物性

XLogP
1.5
極性表面積
0 Ų
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
0
重原子数
4

実験および物理化学的性質

Chemical ClassesOther Classes -> Halogenated Cyclic Hydrocarbons
SpringerMaterials PropertiesSchoenflies notation
Physical DescriptionColorless liquid; [Alfa Aesar MSDS]

物理化学的性質

沸点
69 °C · 69 °C (lit.)
比重(密度)
1.51 g/mL · 1.51 g/mL at 25 °C (lit.)
屈折率
20 · n20/D 1.458(lit.)
闪点
20 °F · 20 °F
貯蔵温度
2 · 2-8°C
溶解性
Chloroform (Sparingly), Methanol (Slightly)

化学的性質

化学的特性Light yellow to clear colourless liquid, boiling point 67-69°C, refractive index (nD20) 1.4605, density (d420) 1.5120, flash point -6°C.

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationBromocyclopropane: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS] See Iodocyclohexane. See Ethyl bromide.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)

安全データ

F
8-19
wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 2
hs_code
29035990
risk_code
11-36/37/38

化学と産業

用途と製造

General Manufacturing InformationCyclopropane, bromo-: ACTIVE
応用分野 · 3 件

用途有機合成原料。

説明Cyclopropyl bromide is also named as Bromocyclopropane. It is used in organic synthesis, for instance, for the formation of a Grignard Reagent, cyclopropyllithium. It is also used as an intermediate in the manufacture of pharmaceutical and agrochemical products.

使用Bromocyclopropane is primarily used an intermediate in the manufacture of pharmaceutical and agrochemical products. It is also used in the production of cyclopropyl boric acid. It is used as an intermediate in organic synethesis.

調製方法 · 1 件

製造方法Bromocyclopropane has been prepared by the Hunsdiecker reaction by adding silver cyclopropanecarboxylate to bromine in dichlorodifluoromethane at 29° (53% yield) or in tetrachloroethane at 20° to 25° (15–20% yield). Decomposition of the peroxide of cyclopropanecarboxylic acid in the presence of carbon tetrabromide gave bromocyclopropane in 43% yield. An attempt to prepare the bromide via the von Braun reaction was unsuccessful. Ten percent yields are reported for the photobromination of cyclopropane and the photochemical rearrangement of allyl bromide. Treatment of 1,1,3-tribromopropane with methyllithium prepared from methyl bromide furnishes a 60–65% yield of bromocyclopropane.

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関連反応

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