6-Methoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride

HCID 2920335

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: 57196-62-0
標準SMILES: COc1ccc2c(c1)CCNC2.Cl
InChIKey: QIUIKPQXMJJOQT-UHFFFAOYSA-N
分子式: C10H14ClNO
平均分子量: 199.68 g/mol
単同位体質量: 199.07639175

名称と識別子

優先名称: 6-Methoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
IUPAC: 6-methoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride

名称と別名

6-Methoxy-1,2,3,4-tetrahydroisoquinoline hydrochlorideRefChem:543534676-564-257196-62-0MFCD01717328Isoquinoline, 1,2,3,4-tetrahydro-6-methoxy-, hydrochloride6-Methoxy-1,2,3,4-tetrahydroisoquinolinehydrochloride6-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLINE HYDROCHLORIDEF3111-01206-Methoxy-1,2,3,4-tetrahydro-isoquinoline HCl6-methoxy-1,2,3,4-tetrahydroisoquinoline HClSCHEMBL587493

名称をさらに表示

orb31437556-methoxy-1,2,3,4-tetraihydroisoquinoline hydrochlorideDTXSID50972647QIUIKPQXMJJOQT-UHFFFAOYSA-N6-Methoxy-1,2,3,4-tetrahydroisSMSSF-0535971CS-M3403TYD-03093

データベース識別子

CAS: 57196-62-0
PubChem CID: 2920335
DTXSID: DTXSID50972647
EC Number: 676-564-2

物性

構造計算による物性補完中

極性表面積: 21.3 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 13
形式電荷: 0
複雑度: 149

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (16.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.