1,2-Dihydro-2,7-naphthyridin-1-one 分子结构式
HCID820151

1,2-Dihydro-2,7-naphthyridin-1-one

2H-2,7-naphthyridin-1-one

C8H6N2O146.15 g/molCAS 67988-50-5

IDENTITY

结构与身份

标准SMILES
O=c1[nH]ccc2ccncc12
InChIKey
GCCFYOUSCICNCD-UHFFFAOYSA-N
分子式
C8H6N2O
平均分子量
146.15 g/mol
单同位素质量
146.04801282

COMPUTED

结构计算性质

已同步
XLogP
0.3
极性表面积
42 Ų
氢键供体
1
氢键受体
2
可旋转键
0
重原子
11
形式电荷
0
复杂度
200

GHS

GHS分类

来源:PubChem
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

来源:PubChem
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 31 条
67988-50-51,2-dihydro-2,7-naphthyridin-1-oneRefChem:411663835-769-92,7-naphthyridin-1(2h)-one2H-2,7-naphthyridin-1-one2,7-naphthyridin-1-ol2H-[2,7]naphthyridin-1-oneMFCD11877928MFCD03085926pyrido[3,4-c]pyridone1-hydroxy-2,7-naphthyridineSCHEMBL276689SCHEMBL2766902,7-naphthyridin-1(7h)-oneSCHEMBL1159186SCHEMBL1159890SCHEMBL3358801GCCFYOUSCICNCD-UHFFFAOYSA-NUS12338238, Example 5

REACTIONS

参与反应

4
HRID 518285 反应方程式

uspto-grants-2015_08 · 10.6084/m9.figshare.5104873.v1 · US09115114B2

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HRID 575556 反应方程式

uspto-grants-2015_05 · 10.6084/m9.figshare.5104873.v1 · US09034900B2

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HRID 879382 反应方程式

uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08987250B2

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HRID 1725515 反应方程式

uspto-grants-2009_02 · 10.6084/m9.figshare.5104873.v1 · US07491722B2

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