HCID16244389

Methyl 1,2,3,4-tetrahydroquinoline-7-carboxylate

C11H13NO2191.23 g/molCAS 597562-79-3

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1ccc2c(c1)NCCC2
InChIKey: BDMQUHKEECRIDC-UHFFFAOYSA-N
分子式: C11H13NO2
平均分子量: 191.23 g/mol
单同位素质量: 191.09462866

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 38.3 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 2
重原子: 14
形式电荷: 0
复杂度: 217

GHS

GHS分类

GHS Classification

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

Hazard Classes and Categories

Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 20 条

methyl 1,2,3,4-tetrahydroquinoline-7-carboxylate597562-79-3RefChem:812472827-662-01,2,3,4-TETRAHYDRO-QUINOLINE-7-CARBOXYLIC ACID METHYL ESTERMFCD085442721,2,3,4-TETRAHYDRO-QUINOLINE-7-CARBOXYLIC ACID METHYL ESTER HYDROCHLORIDESCHEMBL554225SCHEMBL30955089BDMQUHKEECRIDC-UHFFFAOYSA-NSB37861BS-29126SY283246CS-0107313Methyl 1234-tetrahydroquinoline-7-carboxylateD76727EN300-374211methyl1,2,3,4-tetrahydroquinoline-7-carboxylateF612343Methyl 1,2,3,4-tetrahydro-quinoline-7-carboxylate

REACTIONS