结构:O=c1[nH][nH]c2ccccc12
HCID81829

Indazolinone

1,2-dihydroindazol-3-one

C7H6N2O134.14 g/molCAS 7364-25-2

IDENTITY

结构与身份

标准 SMILES
O=c1[nH][nH]c2ccccc12
InChIKey
SWEICGMKXPNXNU-UHFFFAOYSA-N
分子式
C7H6N2O
平均分子量
134.14 g/mol
单同位素质量
134.04801282

COMPUTED

结构计算性质

已同步
XLogP
1.2
极性表面积
41.1 Ų
氢键供体
2
氢键受体
2
可旋转键
0
重原子
10
形式电荷
0
复杂度
158

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. 2 (100%);STOT SE 3 (100%)

USES

用途与制造

来源:PubChem
General Manufacturing Information

3H-Indazol-3-one, 1,2-dihydro-: INACTIVE

ALIASES

名称与别名

83
3-Indazolinone7364-25-2IndazolinoneDTXSID20494288E254S9S1RNSC-9352DTXCID1029388RefChem:411682230-904-21H-Indazol-3-ol1H-indazol-3(2H)-one100922-96-11,2-dihydroindazol-3-one3-Hydroxy-1H-indazole2H-Indazol-3-ol1,2-Dihydro-3H-indazol-3-one3H-Indazol-3-one, 1,2-dihydro-3-Indazolone3-Oxo-1,2-indazolehydroxyindazole

REACTIONS

参与反应

5
HRID287786

Training data from https://doi.org/10.1039/C8SC04228D (8/10)

作为反应物
HRID 287786 方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看条件与参与物
HRID1237348

Training data from https://doi.org/10.1039/C8SC04228D (5/10)

作为反应物
HRID 1237348 方程式

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看条件与参与物