3-(Dimethylamino)-1-(thiophen-2-yl)propan-1-one hydrochloride

HCID 2876891

ノート反応

データを補完しています。通常は 1 分以内に完了します

部分構造検索類似構造を探す

基本情報

CAS: 5424-47-5
標準SMILES: CN(C)CCC(=O)c1cccs1.Cl
InChIKey: HPVHJPMLORARSR-UHFFFAOYSA-N
分子式: C9H14ClNOS
平均分子量: 219.73 g/mol
単同位体質量: 219.0484629

名称と識別子

優先名称: 3-(Dimethylamino)-1-(thiophen-2-yl)propan-1-one hydrochloride
IUPAC: 3-(dimethylamino)-1-thiophen-2-ylpropan-1-one;hydrochloride

名称と別名

3-(dimethylamino)-1-(thiophen-2-yl)propan-1-one hydrochlorideRefChem:495017611-117-75424-47-53-(Dimethylamino)-1-(2-thienyl)-1-propanone Hydrochloride3-Dimethylamino-1-(2-thienyl)-1-propanone hydrochloride2-[3-(Dimethylamino)propionyl]thiophene HydrochlorideMFCD001263491-Propanone, 3-(dimethylamino)-1-(2-thienyl)-, hydrochloride3-(dimethylamino)-1-thiophen-2-ylpropan-1-one;hydrochlorideNSC-122212-thienyl 2-dimethylaminoethyl ketone hydrochloride

名称をさらに表示

3-(DIMETHYLAMINO)-1-(2-THIENYL)-1-PROPANONE HCLBIM-0008383.P001Cambridge id 5927860DTXSID50386942HPVHJPMLORARSR-UHFFFAOYSA-N4DT8UA8475NSC12221NSC 12221

データベース識別子

CAS: 5424-47-5
PubChem CID: 2876891
DTXSID: DTXSID50386942
UNII: 4DT8UA8475
EC Number: 611-117-7

物性

構造計算による物性補完中

極性表面積: 48.6 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 4
重原子数: 13
形式電荷: 0
複雑度: 159

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (11.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (11.1%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (88.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (11.1%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (88.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 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 CategoriesAcute Tox. 4 (11.1%)；Skin Irrit. 2 (88.9%)；Skin Sens. 1 (11.1%)；Eye Dam. 1 (11.1%)；Eye Irrit. 2 (88.9%)；Acute Tox. 4 (11.1%)；STOT SE 3 (88.9%)