5'-クロロ-2'-ヒドロキシプロピオフェノン塩化物

5'-Chloro-2'-hydroxypropiophenone

HCID 292114

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 2892-16-2
標準SMILES: CCC(=O)c1cc(Cl)ccc1O
InChIKey: IVNYWGRYCXKHDW-UHFFFAOYSA-N
分子式: C9H9ClO2
平均分子量: 184.62 g/mol
単同位体質量: 184.0291072

名称と識別子

優先名称: 5'-Chloro-2'-hydroxypropiophenone
IUPAC: 1-(5-chloro-2-hydroxyphenyl)propan-1-one
現地名: 5'-クロロ-2'-ヒドロキシプロピオフェノン塩化物
英語名: 5'-Chloro-2'-hydroxypropiophenone
分子式: C9H9ClO2
分子量: 184.62

名称と別名

5'-chloro-2'-hydroxypropiophenoneDTXSID50303290RefChem:527475DTXCID20254422640-810-72892-16-21-(5-chloro-2-hydroxyphenyl)propan-1-oneMFCD002185791-Propanone, 1-(5-chloro-2-hydroxyphenyl)-1-Propanone,1-(5-chloro-2-hydroxyphenyl)-NSC157733SCHEMBL2070612

名称をさらに表示

5'-クロロ-2'-ヒドロキシプロピオフェノン塩化物5'-クロロ-2'-ヒドロキシプロピオフェノン5’-Chloro-2’-hydroxypropiophenone1-(5-chloro-2-hydroxyphenyl)-1-propanoneJRH-01103, 1-(5-Chloro-2-hydroxyphenyl)propan-1-one, 97%

IVNYWGRYCXKHDW-UHFFFAOYSA-NHMS1788F17CAA892165'-chloro-2'-hydroxy-propiophenoneAKOS000299342NSC-157733NS-01659SY129597

データベース識別子

CAS: 2892-16-2
PubChem CID: 292114
DTXSID: DTXSID50303290
EC Number: 640-810-7

物性

構造計算による物性

XLogP: 3.2
極性表面積: 37.3 Å²
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: 2
重原子数: 12
形式電荷: 0
複雑度: 170

物理化学的性質

融点: 55 · 55-57°C

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

hs_code: 2914790090
risk_code: 36/37/38
safety_code: 26-36/37/39

化学と産業

応用分野

用途有機合成原料。

調製方法 · 1 件

製造方法Preparation by Fries rearrangement of 4-chlorophenyl propionate without solvent, with titanium tetrachloride at 50° for 3 h (59%) Preparation by acylation of p-chlorophenol with propionic acid in the presence of boron trifluoride in a sealed tube at 150° for 5 h (82%).

上流・下流製品情報

下流製品

2H-1-Benzopyran-2-one, 6-chloro-4-hydroxy-3-Methyl-1-(3-Bromo-5-chloro-2-hydroxyphenyl)-1-propanone

サプライヤー14 社

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]

陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]

化合物ノート

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