3-(Dimethylamino)-1-(3-methoxyphenyl)-2-methylpropan-1-one

HCID 19360495

基本情報

CAS
197145-37-2
標準SMILES
COc1cccc(C(=O)C(C)CN(C)C)c1
InChIKey
YHCVGGJYRMYIGG-UHFFFAOYSA-N
分子式
C13H19NO2
平均分子量
221.29 g/mol
単同位体質量
221.14157885

名称と識別子

優先名称
3-(Dimethylamino)-1-(3-methoxyphenyl)-2-methylpropan-1-one
IUPAC
3-(dimethylamino)-1-(3-methoxyphenyl)-2-methylpropan-1-one
英語名
3-(Dimethylamino)-1-(3-methoxyphenyl)-2-methyl-1-propanone
分子式
C13H19NO2
分子量
221.3

名称と別名

197145-37-23-(Dimethylamino)-1-(3-methoxyphenyl)-2-methylpropan-1-one3-(dimethylamino)-1-(3-methoxyphenyl)-2-methyl-1-propanoneDTXSID70598348RefChem:495012DTXCID60549107606-357-41-Propanone, 3-(dimethylamino)-1-(3-methoxyphenyl)-2-methyl-MFCD180727231-Propanone,3-(dimethylamino)-1-(3-methoxyphenyl)-2-methyl-YHCVGGJYRMYIGG-UHFFFAOYSA-N-2-methylpropan-1-one
名称をさらに表示
3- (dimethylamino) -1- (3-methoxyphenyl) -2-methylacetone3-(dimethylamino)-l -(3-methoxyphenyl)-2-methyl-l -propanoneCAS197145-37-2 3-(Dimethylamino)-1-(3-methoxyphenyl)-2-methyl-1-propanone3-(DIMETHYLAMINO)-1-(3-METHOXYPHENOL)-2-METHOXYPROPAN-1-ONE HYDROCHLORIDE
AE5P3DQJ3ASCHEMBL670522SCHEMBL123938643-Dimethylamino-1-(3-methoxyphenyl)-2-methyl-1-propanoneCS-M0174AKOS015909040SB47508SB80056

データベース識別子

CAS
197145-37-2
PubChem CID
19360495
DTXSID
DTXSID70598348
UNII
AE5P3DQJ3A
EC Number
606-357-4

物性

構造計算による物性

XLogP
2.1
極性表面積
29.5 Ų
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
5
重原子数
16

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 50% (2 of 4) of reports.

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H411 (50%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 2 of 4 reports by companies.;There is 1 notification provided by 2 of 4 reports by companies with hazard statement code(s).;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

Regulatory InformationStatus: Active Update: 10-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34448
Hazard Classes and CategoriesAcute Tox. 4 (50%);Skin Irrit. 2 (50%);Skin Sens. 1 (50%);Eye Irrit. 2 (50%);Aquatic Chronic 2 (50%)

法規制情報

Regulatory InformationStatus: Active Update: 10-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34448

安全データ

注意喚起語
警告
危険有害性情報
コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H302

化学と産業

上流・下流製品情報

サプライヤー29 社

奥夫仑医药(四川)有限公司17336178085 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]

関連反応

2 件

化合物ノート

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