N-メチル-N-[4-(トリフルオロメチル)ベンジル]アミン

Benzenemethanamine, N-methyl-4-(trifluoromethyl)-

HCID 485420

基本情報

CAS
90390-11-7
標準SMILES
CNCc1ccc(C(F)(F)F)cc1
InChIKey
YMSMEZAYZIYFGA-UHFFFAOYSA-N
分子式
C9H10F3N
平均分子量
189.18 g/mol
単同位体質量
189.07653381

名称と識別子

優先名称
Benzenemethanamine, N-methyl-4-(trifluoromethyl)-
IUPAC
N-methyl-1-[4-(trifluoromethyl)phenyl]methanamine
現地名
N-メチル-N-[4-(トリフルオロメチル)ベンジル]アミン
英語名
N-Methyl-N-[4-(trifluoromethyl)benzyl]amine
分子式
C9H10F3N
分子量
189.18

名称と別名

90390-11-7n-methyl-n-[4-(trifluoromethyl)benzyl]amineBenzenemethanamine, N-methyl-4-(trifluoromethyl)-DTXSID70238136n-methyl-n-(4-(trifluoromethyl)benzyl)amineRefChem:563344DTXCID90160627816-479-1N-Methyl-1-(4-(trifluoromethyl)phenyl)methanamineN-Methyl-4-(trifluoromethyl)benzylamineN-methyl-1-[4-(trifluoromethyl)phenyl]methanamineMFCD04115411
名称をさらに表示
N-メチル-N-[4-(トリフルオロメチル)ベンジル]アミンCHEMBRDG-BB 4004319METHYL-(4-TRIFLUOROMETHYL-BENZYL)-AMINEN-[4-(Trifluoromethyl)benzyl]-N-methylamineN-methyl-1-[4-(trifluoromethyl)phenyl]methanamine(SALTDATA: FREE)
N-Methyl-4-trifluoromethylbenzyl aminemethyl({[4-(trifluoromethyl)phenyl]methyl})amine90389-03-0methyl([[4-(trifluoromethyl)phenyl]methyl])amineA1AM5SCHEMBL296280SCHEMBL2096206CHEMBL1178152

データベース識別子

CAS
90390-11-7
PubChem CID
485420
DTXSID
DTXSID70238136
ChEMBL
CHEMBL1178152
EC Number
816-479-1

物性

構造計算による物性

XLogP
2.2
極性表面積
12 Ų
水素結合供与体数
1
水素結合受容体数
4
回転可能結合数
2
重原子数
13

物理化学的性質

沸点
187 ℃ · 187.0℃
比重(密度)
1.149 · 1.149
闪点
66.9 ℃ · 66.9℃
貯蔵温度
2 · 2-8°C(protect from light)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];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, P305+P354+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 2 reports by companies from 2 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 (50%);Skin Irrit. 2 (100%);Eye Dam. 1 (50%);STOT SE 3 (100%)

安全データ

hs_code
2921490090
risk_code
36/37/38-34-22
safety_code
26-36/37/39-45-23

化学と産業

サプライヤー66 社

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]

関連反応

3 件

化合物ノート

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