3',5'-ジクロロ-2'-ヒドロキシアセトフェノン 塩化物

3',5'-Dichloro-2'-hydroxyacetophenone

HCID 520608
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基本情報

CAS
3321-92-4
標準SMILES
CC(=O)c1cc(Cl)cc(Cl)c1O
InChIKey
CJFYGRLJDKWMDI-UHFFFAOYSA-N
分子式
C8H6Cl2O2
平均分子量
205.03 g/mol
単同位体質量
203.9744848

名称と識別子

優先名称
3',5'-Dichloro-2'-hydroxyacetophenone
IUPAC
1-(3,5-dichloro-2-hydroxyphenyl)ethanone
現地名
3',5'-ジクロロ-2'-ヒドロキシアセトフェノン 塩化物
英語名
3',5'-Dichloro-2'-hydroxyacetophenone
分子式
C8H6Cl2O2
分子量
205.04

名称と別名

3',5'-Dichloro-2'-hydroxyacetophenoneRefChem:484550628-184-33321-92-41-(3,5-dichloro-2-hydroxyphenyl)ethanone1-(3,5-dichloro-2-hydroxyphenyl)ethan-1-one3,5-Dichloro-2-hydroxyacetophenoneMFCD000164172-Acetyl-4,6-dichlorophenol3'5'-dichloro-2'-hydroxyacetophenoneEthanone, 1-(3,5-dichloro-2-hydroxyphenyl)-1-acetyl-3,5-dichloro-2-hydroxybenzene
名称をさらに表示
3',5'-ジクロロ-2'-ヒドロキシアセトフェノン 塩化物3',5'-ジクロロ-2'-ヒドロキシアセトフェノン2-アセチル-4,6-ジクロロフェノールLABOTEST-BB LT004540781-(3,5-Dichloro-2-hydroxyphenyl)3',5'-Dichloro-2'-hyroxyacetophenone2'-Hydroxy-3',5'-dichloroacetophenoneAcetophenone, 3',5'-dichloro-2'-hydroxy-
4,6-Dichloro-2-acetylphenolSCHEMBL659333SCHEMBL6378496SCHEMBL29613154DTXSID30334406STR03381BBL027817SBB057875

データベース識別子

CAS
3321-92-4
PubChem CID
520608
DTXSID
DTXSID30334406
EC Number
628-184-3
Nikkaji
J1.137.135C

物性

構造計算による物性

XLogP
3.1
極性表面積
37.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
1
重原子数
12

物理化学的性質

融点
94 · 94-97 °C(lit.)
沸点
132 · 132-134 °C18 mm Hg(lit.)
比重(密度)
1.3806 · 1.3806 (rough estimate)
屈折率
1.549 · 1.5490 (estimate)
闪点
132 · 132-134°C/18mm
貯蔵温度
Sealed in dry,Room Temperature

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): 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 45 reports by companies from 5 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

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.8%)

安全データ

wgk
3
hs_code
29147000
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36

化学と産業

応用分野

用途有機合成原料。

調製方法

製造方法Preparation by Fries rearrangement of 2,4-dichlorophenyl acetate with aluminium chloride in tetrachloroethane at 150–160° and without solvent between 115° and 170° (43–75%).

上流・下流製品情報

サプライヤー57 社

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
北京诺德恒信化工技术有限公司010-84929330 13811281791 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

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