1-Bromo-1-propene

HCID 11533CAS 590-14-7

部分構造検索類似構造を探す

基本情報

標準SMILES: CC=CBr
InChIKey: NNQDMQVWOWCVEM-UHFFFAOYSA-N
分子式: C3H5Br
平均分子量: 120.98 g/mol
単同位体質量: 119.95746226

概要

See also: cis-1-Bromo-1-propene (annotation moved to).

名称と識別子

優先名称: 1-Bromo-1-propene
IUPAC: 1-bromoprop-1-ene

名称と別名

1-Bromo-1-propene590-14-7Propenyl bromide1-Propene, 1-bromo-DTXSID0060438RefChem:1055017DTXCID7042512209-671-61-bromoprop-1-enebromopropene590-13-61-propene, 1-bromo-, (1Z)-

名称をさらに表示

1-Bromo-1-propene (cis- and trans- mixture)1 -bromopropenealpha-bromopropeneBromo-1-propene1-bromo 1-propenetrans-1-Bromo-1-propene - stablised with CopperSCHEMBL245914SCHEMBL246251

データベース識別子

CAS: 590-14-7
PubChem CID: 11533
DTXSID: DTXSID0060438
EC Number: 209-671-6

物性

構造計算による物性

XLogP: 1.8
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: 0
重原子数: 4
形式電荷: 0
複雑度: 22.5

実験および物理化学的性質

Chemical ClassesOther Classes -> Halogenated Aliphatics, Unsaturated

SpringerMaterials PropertiesDensity

Physical DescriptionClear, light yellow liquid; [Aldrich MSDS]

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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazards SummaryCauses other liver changes in 1-week intermittent inhalation studies of rats; [RTECS] A skin and strong eye irritant; [Aldrich MSDS] See 1-Chloro-1-propene.

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