2-Methylquinolin-4-ol 分子结构式
HCID178428811

2-Methylquinolin-4-ol

2-methyl-1H-quinolin-4-one

C10H9NO159.18 g/mol

IDENTITY

结构与身份

标准SMILES
Cc1cc(O)c2ccccc2n1
InChIKey
NWINIEGDLHHNLH-UHFFFAOYSA-N
分子式
C10H9NO
平均分子量
159.18 g/mol
单同位素质量
159.06841391

COMPUTED

结构计算性质

已同步
XLogP
1.9
极性表面积
29.1 Ų
氢键供体
1
氢键受体
2
可旋转键
0
重原子
12
形式电荷
0
复杂度
232

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 (97.8%): 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)

Aggregated GHS information provided per 45 reports by companies from 5 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.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);STOT SE 3 (97.8%)

ALIASES

名称与别名

共 81 条
4-Hydroxy-2-methylquinoline2-Methylquinolin-4-ol607-67-0EINECS 210-140-6DTXSID40209515NSC 21483RefChem:476257DTXCID90132006210-140-62-methylquinolin-4(1H)-one2-Methyl-4-quinolinol2-methyl-1H-quinolin-4-one4-Quinolinol, 2-methyl-4-Hydroxyquinaldine2-Methyl-4-hydroxyquinoline4(1H)-Quinolinone, 2-methyl-MFCD000067582-Methyl-quinolin-4-ol1H-4-Oxoquinaldine2-methyl-quinolin-4(1H)-one

REACTIONS

参与反应

25
HRID 40805 反应方程式

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08530491B2

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HRID 94002 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID 101772 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID 133410 反应方程式

uspto-grants-2008_06 · 10.6084/m9.figshare.5104873.v1 · US07390833B2

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HRID 182249 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID 228897 反应方程式

uspto-grants-2009_07 · 10.6084/m9.figshare.5104873.v1 · US07560558B2

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HRID 507264 反应方程式

uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786139B2

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HRID 675473 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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