3-ブロモ-5-クロロチオフェン-2-スルホニルクロリド

3-Bromo-5-chlorothiophene-2-sulfonyl chloride

HCID 2737400

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 175205-72-8
標準SMILES: O=S(=O)(Cl)c1sc(Cl)cc1Br
InChIKey: IJWGXKAPAGXFRO-UHFFFAOYSA-N
分子式: C4HBrCl2O2S2
平均分子量: 296 g/mol
単同位体質量: 293.79784

名称と識別子

優先名称: 3-Bromo-5-chlorothiophene-2-sulfonyl chloride
IUPAC: 3-bromo-5-chlorothiophene-2-sulfonyl chloride
現地名: 3-ブロモ-5-クロロチオフェン-2-スルホニルクロリド
英語名: 3-BROMO-5-CHLOROTHIOPHENE-2-SULFONYL CHLORIDE
分子式: C4HBrCl2O2S2
分子量: 295.99

名称と別名

3-bromo-5-chlorothiophene-2-sulfonyl chloride175205-72-8DTXSID20372039RefChem:498879DTXCID30323072676-280-93-Bromo-5-chlorothiophene-2-sulfonylchlorideMFCD000520953-bromo-5-chlorothiophene-2-sulphonyl chloride2-Thiophenesulfonyl chloride, 3-bromo-5-chloro-3-bromo-5-chloro-thiophene-2-sulfonyl Chloride3-bromo-5-chloro-2-thiophenesulfonyl chloride

名称をさらに表示

3-ブロモ-5-クロロチオフェン-2-スルホニルクロリド

3-bromo-5-chloro-2-(chlorosulphonyl)thiopheneSCHEMBL3909023-bromo-5-chlorothiophene-2-sulfonyl chloride, 95+%IJWGXKAPAGXFRO-UHFFFAOYSA-NAKOS005259641AT16700AS-91975SY103910

データベース識別子

CAS: 175205-72-8
PubChem CID: 2737400
DTXSID: DTXSID20372039
EC Number: 676-280-9

物性

構造計算による物性

XLogP: 3.6
極性表面積: 70.8 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 11
形式電荷: 0
複雑度: 237

物理化学的性質

融点: 34 · 34-36°C
沸点: 346.7 · 346.7±42.0 °C(Predicted)
比重(密度): 2.059 · 2.059±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C
外見: solid
色: Pale brown

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]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P337+P317, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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.