uspto-grants-1981_03 · 10.6084/m9.figshare.5104873.v1 · US04255580
查看IDENTITY
结构与身份
- 标准SMILES
- CN1CCCC1CN
- InChIKey
- JUFKJRCMBLLXNH-UHFFFAOYSA-N
- 分子式
- C6H14N2
- 平均分子量
- 114.19 g/mol
- 单同位素质量
- 114.11569846
COMPUTED
结构计算性质
- XLogP
- -0.1
- 极性表面积
- 29.3 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 1
- 重原子
- 8
- 形式电荷
- 0
- 复杂度
- 72
GHS
GHS分类
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, 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
Hazard Classes and Categories
Flam. Liq. 3 (100%);Skin Corr. 1B (100%)
ALIASES
名称与别名
REACTIONS
相关反应
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