huagongshe.com
结构：COC(=O)c1cc(Cl)c2cc(Cl)ccc2n1
HCID29923271

Methyl 4,6-dichloroquinoline-2-carboxylate

C11H7Cl2NO2256.08 g/molCAS 848501-96-2
查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准 SMILES
COC(=O)c1cc(Cl)c2cc(Cl)ccc2n1
InChIKey
AHTTVCBWDAOWBI-UHFFFAOYSA-N
分子式
C11H7Cl2NO2
平均分子量
256.08 g/mol
单同位素质量
254.9853839

COMPUTED

结构计算性质

已同步
XLogP
3.6
极性表面积
39.2 Ų
氢键供体
0
氢键受体
3
可旋转键
2
重原子
16
形式电荷
0
复杂度
275

GHS

GHS 分类

来源：PubChem
GHS Classification

Warning

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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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

来源：PubChem
Hazard Classes and Categories

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

ALIASES

名称与别名

共 19 条
METHYL 4,6-DICHLOROQUINOLINE-2-CARBOXYLATE848501-96-2DTXSID10652216RefChem:815700DTXCID40602966889-622-9MFCD08458388SCHEMBL3284191SCHEMBL30629557AHTTVCBWDAOWBI-UHFFFAOYSA-NYIB50196AKOS012682482SB68673BS-24196CS-0099697EN300-129452H58777methyl 4,6-bis(chloranyl)quinoline-2-carboxylateZ1134173744

REACTIONS

参与反应

2 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂