3-Bromopentane (HCID 15738)

名称と識別子

優先名称: 3-Bromopentane
IUPAC: 3-bromopentane
現地名: 3-ブロモペンタン
英語名: 3-Bromopentane
分子式: C5H11Br
分子量: 151.04

名称と別名

3-BROMOPENTANEPentane, 3-bromo-3-Pentyl bromideEINECS 217-314-0DTXSID2061987RefChem:93252DTXCID0035740217-314-0InChI=1/C5H11Br/c1-3-5(6)4-2/h5H,3-4H2,1-2HVTOQFOCYBTVOJZ-UHFFFAOYSA-N1809-10-5MFCD00000158

名称をさらに表示

3-ブロモペンタン3-ペンチルブロミド3-ブロモペンタン, 97%DK612DKSI1683-broMideDKFELEX01523-Pentylbromid3-bromo-pentanpentane,3-bromo-3-Bromopentane,97%

3-bromo-pentane3-Pentyl Bromide;3-pentylbromide3-Bromopentane, 95%SCHEMBL82623SCHEMBL82624SCHEMBL1417603SCHEMBL7863991

データベース識別子

CAS: 1809-10-5
PubChem CID: 15738
DTXSID: DTXSID2061987
EC Number: 217-314-0
Nikkaji: J97.466H

物性

構造計算による物性

XLogP: 2.8
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: 6
形式電荷: 0
複雑度: 23.1

実験および物理化学的性質

SpringerMaterials PropertiesBoiling point

物理化学的性質

融点: -126.2 °C · -126.2°C
沸点: 118 · 118-119 °C (lit.)
比重(密度): 1.216 g/mL · 1.216 g/mL at 25 °C (lit.)
屈折率: 20 · n20/D 1.445(lit.)
闪点: 65 °F · 65 °F
貯蔵温度: Sealed in dry,Room Temperature
溶解性: エタノール、エーテル、ベンゼン、クロロホルムと混和します。
外見: 液体
色: 澄んだ薄黄色
BRN: 1730967 · 1730967
Dielectric constant: 8.37 · 8.3699999999999992
InChI: InChI=1S/C5H11Br/c1-3-5(6)4-2/h5H,3-4H2,1-2H3
InChIKey: VTOQFOCYBTVOJZ-UHFFFAOYSA-N
SMILES: CCC(Br)CC
CAS データベース: 1809 · 1809-10-5(CAS DataBase Reference)
EPAの化学物質情報: 3 · Pentane, 3-bromo- (1809-10-5)

化学的性質

化学的特性Clear pale yellow liquid

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 56 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

安全データ

F: 19
wgk: 3
tsca: TSCA listed
ridadr: UN 1993 3/PG 2
hs_code: 29033990
risk_code: 11-36/37/38
化審法: (2)-67
消防法: 危-4-1-II
hazard_code: F,Xi
safety_code: 16-26-36
hazard_class: 3
packing_group: II
Hazard Classifications: Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 3 - Flammable liquids

化学と産業

用途と製造

General Manufacturing InformationPentane, 3-bromo-: ACTIVE

応用分野

使用3-Bromopentane is a glass forming liquid used in the preparation of 2-(1-ethyl-propoxy)-isoindole-1,3-dione. Further, it is employed in organic synthesis.

一般的な説明3-Bromopentane is a glass forming liquid. The dielectric relaxation of 3-bromopentane was studied.

調製方法 · 1 件

製造方法Isomerically pure 3-bromopentane could be prepared from tri-1-ethylpropyl phosphite and hydrogen bromide and solvolysed in 60% aqueous ethanol. The detection of about 1% rearrangement products in both acid and weakly alkaline conditions supports the view that carbonium ion intermediates are formed in the reaction of at least a proportion of the molecules[1].