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结构：c1cn2ncnc2cn1
HCID136241

[1,2,4]Triazolo[1,5-a]pyrazine

C5H4N4120.11 g/molCAS 399-66-6
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IDENTITY

结构与身份

标准 SMILES
c1cn2ncnc2cn1
InChIKey
DFDJVPRVKHSWQH-UHFFFAOYSA-N
分子式
C5H4N4
平均分子量
120.11 g/mol
单同位素质量
120.04359615

COMPUTED

结构计算性质

已同步
XLogP
-0.3
极性表面积
43.1 Ų
氢键供体
0
氢键受体
3
可旋转键
0
重原子
9
形式电荷
0
复杂度
105

PROPERTIES

实验与物化性质

来源：PubChem
Kovats Retention Index

1675

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 29 条
[1,2,4]Triazolo[1,5-a]pyrazine399-66-6(1,2,4)Triazolo(1,5-a)pyrazines-Triazolo[1,5-a]pyrazineDTXSID90192943s-Triazolo(1,5-a)pyrazineRefChem:68084DTXCID30115434DFDJVPRVKHSWQH-UHFFFAOYSA-NInChI=1/C5H4N4/c1-2-9-5(3-6-1)7-4-8-9/h1-4MFCD09834988SCHEMBL259029SCHEMBL275037SCHEMBL12079446SCHEMBL22658563SCHEMBL226585671,2,4]triazolo[1,5-a]pyrazine[1,2,4]-triazolo[1,5-a]pyrazineAKOS006328964[1,2,4]triazolo[1,5-alpha]pyrazine

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