ブロモアセチルブロミド

Bromoacetyl bromide

HCID 61147CAS 598-21-0

基本情報

標準SMILES
O=C(Br)CBr
InChIKey
LSTRKXWIZZZYAS-UHFFFAOYSA-N
分子式
C2H2Br2O
平均分子量
201.84 g/mol
単同位体質量
199.84723888

概要

Bromoacetyl bromide appears as a water-white liquid with a pungent odor. Denser than water. Irritates skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.

名称と識別子

優先名称
Bromoacetyl bromide
IUPAC
2-bromoacetyl bromide
現地名
ブロモアセチルブロミド
英語名
Bromoacetyl bromide
分子式
C2H2Br2O
分子量
201.84

名称と別名

Bromoacetyl bromide598-21-0ACETYL BROMIDE, BROMO-Acetyl bromide, 2-bromo-CCRIS 9090EINECS 209-923-5UN2513alpha-bromoacetyl bromideDTXSID10605062bromoacetyl bromideAcetyl bromide, bromoalphaBromoacetyl bromide
名称をさらに表示
ブロモアセチルブロミド2-ブロモアセチルブロミドブロモ酢酸ブロミド1,2-ジブロモエタノンα-ブロモアセチルブロマイド臭化ブロモアセチル臭化ブロムアセチルブロモアセチルブロミド, 98%acetylbromide,bromo-bromoacetylBroMoacetyl brAKOS BBS-00004286bromo-acetylbromid?BROMOACETYL?BROMIBrominemonobromide1,2-Dibromoethanone
Acetyl bromide, 2bromoRefChem:570322BROMOETHANOYL BROMIDEMONOBROMOACETYL BROMIDEDTXCID7042699209-923-52-Bromoacetyl bromidebromoacetylbromide

データベース識別子

CAS
598-21-0
PubChem CID
61147
DTXSID
DTXSID1060506
UNII
GV64Q4VP87
EC Number
209-923-5
Nikkaji
J474J

物性

構造計算による物性

XLogP
1.6
極性表面積
17.1 Ų
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
1
重原子数
5

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Halogenated Ketones

Corrosives

SpringerMaterials PropertiesSchoenflies notation
Density2.317 at 68 °F (USCG, 1999) - Denser than water; will sink
Boiling Point298 °F at 760 mmHg (USCG, 1999)
Physical Description · 2 件

Bromoacetyl bromide appears as a water-white liquid with a pungent odor. Denser than water. Irritates skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.

Fuming water-white liquid with a pungent odor; [CAMEO] Colorless to light yellow liquid with an extremely irritating odor; [CHRIS] Dark brown liquid; [Sigma-Aldrich MSDS]

物理化学的性質

融点
148.5 °C · 148.5°C (estimate)
沸点
147 · 147-150 °C(lit.)
比重(密度)
2.324 g/mL · 2.324 g/mL at 20 °C
蒸気圧
3.8 mm · 3.8 mm Hg ( 25 °C)
屈折率
20 · n20/D 1.547(lit.)
闪点
105 °C · >105°C

化学的性質

化学的特性dark brown-yellow liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 73 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Not Classified

危険有害性情報

Regulatory Information · 4 件

Chemical: Acetyl bromide, bromo-

Status: Active Update: 10-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/17142

Bromoacetyl bromide: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelCorrosive
Fire Hazards · 2 件

Special Hazards of Combustion Products: Heat of fire can cause decomposition, with evolution of highly toxic and irritating hydrogen bromide and bromophosgene vapors.

· Combustible material: may burn but does not ignite readily.

Health Hazards · 2 件

Inhalation causes severe irritation of upper respiratory system. External contact causes severe irritation of eyes and skin. Ingestion causes severe irritation of mouth and stomach. (USCG, 1999)

· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.

Hazards Summary · 1 件

Reacts violently with water evolving hydrogen bromide; Causes severe skin irritation and serious eye injury; Brief contact can cause second- and third-degree skin burns; [CHRIS] Readily hydrolyzes; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract; [Sigma-Aldrich MSDS] See Dichloroacetone. See Hydrogen bromide.

DOT ID and Guide2513 156

安全と保護具

Fire FightingExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Accidental Release Measures · 2 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 件

INHALATION: Remove from exposure; support respiration, call physician.

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:

Immediate precautionary measure

毒性情報

Adverse EffectsDermatotoxin - Skin burns.

安全データ

F
10-19
wgk
3
tsca
TSCA listed
ridadr
UN 2513
hs_code
29159080
risk_code
34-14

化学と産業

用途と製造

UsesUsed in chemical manufacture; [CAMEO]
General Manufacturing InformationAcetyl bromide, 2-bromo-: ACTIVE
応用分野 · 4 件

用途有機合成原料(医薬品)、殺菌剤原料。

用途エーテルとアセタールの選択的開裂

使用Bromoacetyl bromide is widely used in the synthesis of fine chemicals, agrochemicals, dyes and pharmaceuticals. As an acylating agent, it reacts with 10H-phenothiazine to give 10-bromoacetyl-10H-phenothiazine. Similarly, it is also involved in the preparation of bromoactylated starch which is a biodegradable thermoplastic copolymer.

一般的な説明A water-white liquid with a pungent odor. Denser than water. Irritates skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.

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