1,2-Diphenylethyl-N-methylamine

HCID 110986CAS 53663-25-5

基本情報

標準SMILES: CNC(Cc1ccccc1)c1ccccc1
InChIKey: GNMNPHPUCWQGJK-UHFFFAOYSA-N
分子式: C15H17N
平均分子量: 211.3 g/mol
単同位体質量: 211.13609955

名称と識別子

優先名称: 1,2-Diphenylethyl-N-methylamine
IUPAC: N-methyl-1,2-diphenylethanamine
英語名: 1,2-Diphenylethyl-N-methylamine
分子式: C15H17N
分子量: 211.3

名称と別名

1,2-DIPHENYLETHYL-N-METHYLAMINERefChem:411820637-308-5N-methyl-1,2-diphenylethanamine53663-25-5N-methyl-1,2-diphenylethylamineN-Methyl-1,2-diphenylethan-1-amine(1,2-Diphenylethyl)(Methyl)Amine1,2-diphenyl-ethyl-methyl-amineSCHEMBL1541692SCHEMBL2096552SCHEMBL8634299

名称をさらに表示

Benzeneethanamine, N-methyl-α-phenyl-

SCHEMBL27629283DTXSID30276099GNMNPHPUCWQGJK-UHFFFAOYSA-NNSC163179AKOS000171036AKOS016050668NSC-163179

データベース識別子

CAS: 53663-25-5
PubChem CID: 110986
DTXSID: DTXSID30276099
EC Number: 637-308-5

物性

構造計算による物性

XLogP: 3.3
極性表面積: 12 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 4
重原子数: 16
形式電荷: 0
複雑度: 178

物理化学的性質

沸点: 160 · 160-161 °C(Press: 8 Torr)
比重(密度): 1.01 · 1.010±0.06 g/cm3(Predicted)
酸解離定数(Pka): 9.36 · 9.36±0.20(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 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 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

安全データ

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

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