3-Bromo-o-xylene (HCID 68472)

名称と識別子

優先名称: 3-Bromo-o-xylene
IUPAC: 1-bromo-2,3-dimethylbenzene
現地名: 3-ブロモ-o-キシレン
英語名: 2,3-Dimethylbromobenzene
分子式: C8H9Br
分子量: 185.06

名称と別名

3-Bromo-o-xyleneEINECS 209-398-2DTXSID90206231NSC 76561RefChem:499288DTXCID90128722209-398-2576-23-82,3-Dimethylbromobenzene1-Bromo-2,3-dimethylbenzene3-Bromo-1,2-dimethylbenzene1-bromo-2,3-dimethyl-benzene

名称をさらに表示

3-ブロモ-o-キシレン1,2-ジメチル-3-ブロモベンゼン1-ブロモ-2,3-ジメチルベンゼン3-ブロモ-1,2-ジメチルベンゼン2,3-ジメチルブロモベンゼン3‐ブロモ‐O‐キシレン3-ブロモ-o-キシレン, 99%3-Brom-o-xylol3-Bromo-1-xylene3-Bromoxylene,99%3-Bromo-1，2-xylene3-Bromoxylene, 99%3-Bromo-o-xylene,99%3-Bromo-1,2-dimethyL

2,3-Dimethyl bromobenzeneBenzene, 1-bromo-2,3-dimethyl-MFCD00000069NSC-76561bromoxileneXylylbromidbromo-o-xyleneNSC76561

データベース識別子

CAS: 576-23-8
PubChem CID: 68472
DTXSID: DTXSID90206231
UNII: MMB6CL2XRC
EC Number: 209-398-2
Nikkaji: J94.992B

物性

構造計算による物性

XLogP: 3.7
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: 9
形式電荷: 0
複雑度: 90

物理化学的性質

融点: -20.49 °C · -20.49°C (estimate)
沸点: 214 °C · 214 °C(lit.)
比重(密度): 1.365 g/mL · 1.365 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.560(lit.)
闪点: 177 °F · 177 °F
貯蔵温度: 30 °C · Store below +30°C.
溶解性: soluble in Chloroform, DMSO, Methanol
外見: 液体
色: 無色透明
比重: 1.365 · 1.365
水溶解度: 混和しないか、水に混ざりにくい。
BRN: 2077312 · 2077312
InChI: 1S/C8H9Br/c1-6-4-3-5-8(9)7(6)2/h3-5H,1-2H3
InChIKey: WLPXNBYWDDYJTN-UHFFFAOYSA-N
SMILES: Cc1cccc(Br)c1C
CAS データベース: 576 · 576-23-8(CAS DataBase Reference)
NISTの化学物質情報: 1 · Benzene, 1-bromo-2,3-dimethyl-(576-23-8)

化学的性質

化学的特性Clear colourless to light yellow liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (98.1%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (92.5%): 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 53 reports by companies from 12 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

Regulatory InformationStatus: Active Update: 24-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22533

Hazard Classes and CategoriesSkin Irrit. 2 (98.1%)；Eye Irrit. 2A (100%)；STOT SE 3 (92.5%)

法規制情報

Regulatory InformationStatus: Active Update: 24-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22533

安全データ

wgk: 3
ridadr: UN 2810 6.1/PG 3
hs_code: 29039990
risk_code: 36/37/38
消防法: 危-4-3-III
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-36/37/39-24/25
ストレージクラス: 10 - Combustible liquids

化学と産業

応用分野

用途有機合成原料。

使用3-Bromo-o-xylene is an important raw material and intermediate used in organic synthesis, pharmaceuticals and agrochemicals.

上流・下流製品情報

下流製品

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

盐城市胜达化工有限公司0515-83072966 13016507129

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

3-ブロモ-o-キシレン

基本情報