基本情報
- 標準SMILES
CC#CC- InChIKey
XNMQEEKYCVKGBD-UHFFFAOYSA-N- 分子式
- C4H6
- 平均分子量
- 54.09 g/mol
- 単同位体質量
- 54.04695019
概要
Crotonylene appears as a clear colorless liquid with a petroleum-like odor. Less dense than water and insoluble in water. Vapors heavier than air.
名称と識別子
- 優先名称
- Dimethylacetylene
- IUPAC
- but-2-yne
- 英語名
- 2-Butyne
- 分子式
- C4H6
- 分子量
- 54.09
名称と別名
名称をさらに表示
データベース識別子
- CAS
503-17-3- PubChem CID
- 10419
- DTXSID
DTXSID3060116- ChEMBL
CHEMBL119108- UNII
- LKE6D3018E
- EC Number
- 207-962-2
- Nikkaji
- J2.603D
物性
構造計算による物性
- XLogP
- 1.5
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 0
- 回転可能結合数
- 0
- 重原子数
- 4
- 形式電荷
- 0
- 複雑度
- 42.9
実験および物理化学的性質
Chemical Classes
Other Classes -> Aliphatics, Unsaturated
Flammable agents - 4th degree
Physical Description
Crotonylene appears as a clear colorless liquid with a petroleum-like odor. Less dense than water and insoluble in water. Vapors heavier than air.
Clear colorless liquid with an odor of petroleum; [CAMEO]
物理化学的性質
- 融点
- -32.3 °C · -32.3 °C
- 沸点
- 26.9 °C · 26.9 °C
- 比重(密度)
- 0.715 g/cm3 · 0.715 g/cm3(Temp: 0 °C)
安全と法規制
GHS分類
GHS Classification
Danger
H224 (100%): Extremely flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 76 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: 2-Butyne
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire Hazards
Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Health Hazards
Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
CAUTION: Petroleum crude oil (UN1267) may contain TOXIC hydrogen sulphide gas.
Reactivity Profile
CROTONYLENE may react vigorously with strong oxidizing agents. May react exothermically with reducing agents to release hydrogen gas. In the presence of various catalysts (such as acids) or initiators, may undergo exothermic addition polymerization reactions.
DOT Hazard Classification
Crotonylene
UN1144
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG I: the degree of danger presented by the material is great
安全と保護具
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Immediate precautionary measure
毒性情報
安全データ
- 注意喚起語
- 危険
- 危険有害性情報
- コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H224
化学と産業
用途と製造
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