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结构：CCC=CCC
HCID11601

3-Hexene

hex-3-ene

C6H1284.16 g/molCAS 592-47-2
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IDENTITY

结构与身份

标准 SMILES
CCC=CCC
InChIKey
ZQDPJFUHLCOCRG-UHFFFAOYSA-N
分子式
C6H12
平均分子量
84.16 g/mol
单同位素质量
84.09390038

COMPUTED

结构计算性质

已同步
XLogP
2.5
极性表面积
0 Ų
氢键供体
0
氢键受体
0
可旋转键
2
重原子
6
形式电荷
0
复杂度
29

PROPERTIES

实验与物化性质

来源：PubChem
Vapor Pressure

165.0 [mmHg]

Physical Description

Colorless liquid with a mild odor; [CPChem MSDS]

Kovats Retention Index

611；614；602

GHS

GHS 分类

来源：PubChem
GHS Classification

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H304 (100%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]

P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, 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

来源：PubChem
Hazards Summary

May cause mild skin, eye, and respiratory tract irritation; An aspiration hazard following ingestion; [CPChem MSDS] See 3-Heptene.

Hazard Classes and Categories

Flam. Liq. 2 (100%)；Asp. Tox. 1 (100%)

TOXICITY

毒理信息

来源：PubChem
Adverse Effects

Neurotoxin - Acute solvent syndrome

ALIASES

名称与别名

共 29 条
3-HEXENEHex-3-ene592-47-2DTXSID907320240FC9RS24TCHEBI:176800RefChem:1067907DTXCID2042569209-758-9hexa-3-eneSCHEMBL8788SCHEMBL20322SCHEMBL20658SCHEMBL20659SCHEMBL20660SCHEMBL43592SCHEMBL453915SCHEMBL581267SCHEMBL582994SCHEMBL1174180

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