(2,4-ジクロロフェノキシ)アセチルクロリド

(2,4-Dichlorophenyl)acetyl chloride

HCID 2758147

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 53056-20-5
標準SMILES: O=C(Cl)Cc1ccc(Cl)cc1Cl
InChIKey: RYXAJKPGHHNCSO-UHFFFAOYSA-N
分子式: C8H5Cl3O
平均分子量: 223.5 g/mol
単同位体質量: 221.940598

名称と識別子

優先名称: (2,4-Dichlorophenyl)acetyl chloride
IUPAC: 2-(2,4-dichlorophenyl)acetyl chloride
現地名: (2,4-ジクロロフェノキシ)アセチルクロリド
英語名: (2,4-Dichloro-phenyl)-acetyl chloride
分子式: C8H5Cl3O
分子量: 223.48

名称と別名

(2,4-Dichlorophenyl)acetyl chlorideEC 610-950-3RefChem:394575610-950-353056-20-52-(2,4-dichlorophenyl)acetyl chloride(2,4-Dichloro-phenyl)acetyl chlorideMFCD01632173Benzeneacetyl chloride, 2,4-dichloro-Benzeneacetyl chloride,2,4-dichloro-(2,4-dichloro-phenyl)-acetyl chloride2,4-dichlorophenylacetyl chloride

名称をさらに表示

(2,4-ジクロロフェノキシ)アセチルクロリドDichlorophenylacetyl Chloride2,4-dichloro-phenyl chloride2,4-dichlorobenzeneacetyl chloride2-(2,4-dichlorophenoxy)ethanoyl chloride2-chloro-2-(4-chlorophenoxy)acetyl chloride

SCHEMBL657437SCHEMBL30321024RYXAJKPGHHNCSO-UHFFFAOYSA-N(2,4-Dichlorophenyl)-acetyl chloride2,4-dichlorophenylacetic acid chlorideAKOS015891084BS-32526DB-016278

データベース識別子

CAS: 53056-20-5
PubChem CID: 2758147
EC Number: 610-950-3
Nikkaji: J2.181.483K

物性

構造計算による物性

XLogP: 3.9
極性表面積: 17.1 Å²
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: 2
重原子数: 12
形式電荷: 0
複雑度: 172

物理化学的性質

沸点: 286.8 · 286.8±30.0 °C(Predicted)
比重(密度): 1.445 · 1.445±0.06 g/cm3(Predicted)
蒸気圧: 0.02 · 0.02-1.9Pa at 20-50℃
LogP: -0.3 · -0.3-2.8 at 23℃ and pH2-7

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]；H318 (93.3%): Causes serious eye damage [Danger Serious eye damage/eye 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 30 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.