Dimethylacetylene

HCID 10419CAS 503-17-3

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

Dimethylacetylene4-butynebut-4-yneRefChem:860602-BUTYNEBut-2-yne503-17-3CrotonyleneUN1144UNII-LKE6D3018ELKE6D3018EEINECS 207-962-2
名称をさらに表示
MFCD0000927525684-85-9dimethyl acetylene2-BUTINE2-Butyne, 99%SCHEMBL3561SCHEMBL18681SCHEMBL51760

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

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Aliphatics, Unsaturated

Flammable agents - 4th degree

SpringerMaterials PropertiesDunham energy parameter
LogP1.46
Flash Point-4 °F (NFPA, 2010)
Vapor Pressure706.0 [mmHg]
Physical Description · 2 件

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 · 4 件

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 · 2 件

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.)

Other Safety InformationIMAP assessments - 2-Butyne: Human health tier I assessment
DOT LabelFlammable Liquid
Fire Hazards · 2 件

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Health Hazards · 2 件

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:

CAUTION: Petroleum crude oil (UN1267) may contain TOXIC hydrogen sulphide gas.

Hazards SummaryHighly flammable; [CAMEO] Extremely flammable; An irritant; [MSDSonline] See Methylacetylene.

安全と保護具

Fire FightingExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Accidental Release Measures · 2 件

· 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 · 2 件

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:

Immediate precautionary measure

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

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

General Manufacturing Information2-Butyne: ACTIVE

サプライヤー42 社

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関連反応

13 件

関連ノート

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