3,4-ジヒドロ-2H-ピラン-2-カルボアルデヒド

Acrolein dimer

HCID 60994CAS 100-73-2

基本情報

標準SMILES
O=CC1CCC=CO1
InChIKey
NPWYTMFWRRIFLK-UHFFFAOYSA-N
分子式
C6H8O2
平均分子量
112.13 g/mol
単同位体質量
112.0524295

概要

Acrolein dimer, stabilized appears as a colorless or yellow liquid with a pungent disagreeable odor. May be irritating to the eyes and mucous membranes; long-term exposure may result in adverse health effects. Vapors denser than air. Used to make other chemicals, plastics.

名称と識別子

優先名称
Acrolein dimer
IUPAC
3,4-dihydro-2H-pyran-2-carbaldehyde
現地名
3,4-ジヒドロ-2H-ピラン-2-カルボアルデヒド
英語名
2-Formyl-3,4-dihydro-2H-pyran
分子式
C6H8O2
分子量
112.13

名称と別名

3,4-Dihydro-2H-pyran-2-carbaldehydeAcrolein dimer2-Propenal dimer3,4-Dihydro-2H-pyran-2-carboxaldehyde2H-PYRAN-2-CARBOXALDEHYDE, 3,4-DIHYDRO-NSC 954132,3-Dihydro-1,4-pyran-2-karboxaldehydEINECS 202-884-549SA3RBS5HUN2607BRN 0107244NSC-95413
名称をさらに表示
2,6-エポキシ-5-ヘキセナール3,4-ジヒドロ-2H-ピラン-2-カルボアルデヒドアクロレイン二量体2-プロペナール二量体アクロレインダイマーアクロレイン ダイマー3,4-ジヒドロ-2H-ピラン-2-カルブアルデヒド3,4-ジヒドロ-2H-ピラン-2-カルバルデヒドMT-A4AcroleindimerPyranaldehyde2,6-epoxy-5-hexena2,6-epoxy-5-Hexenalacrylaldehyde dimer5-Hexenal, 2,6-epoxy-2-formyl-2,3-dihydropyran
Acrolein dimer, stabilized2,3-Dihydro-1,4-pyran-2-karboxaldehyd [Czech]UNII-49SA3RBS5HUN 2607 (Salt/Mix)DTXSID302741515-17-09-00131 (Beilstein Handbook Reference)3,4-Dihydro-2-carboxaldehyde-2H-pyranACROLEIN DIMER, (STABILIZED)

データベース識別子

CAS
100-73-2
PubChem CID
60994
DTXSID
DTXSID30274151
UNII
49SA3RBS5H
EC Number
202-884-5
Nikkaji
J21.552J

物性

構造計算による物性

XLogP
0.7
極性表面積
26.3 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
1
重原子数
8

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Other Organic Compounds

Flammable agents - 2nd degree

Flash Point118 °F (NFPA, 2010)
Physical Description · 2 件

Acrolein dimer, stabilized appears as a colorless or yellow liquid with a pungent disagreeable odor. May be irritating to the eyes and mucous membranes; long-term exposure may result in adverse health effects. Vapors denser than air. Used to make other chemicals, plastics.

Colorless or yellow liquid with a pungent unpleasant odor; [CAMEO] Clear colorless liquid; [Sigma-Aldrich MSDS]

物理化学的性質

融点
-99.9 °C · -99.9°C
沸点
146 °C · 146 °C(lit.)
比重(密度)
1.08 g/mL · 1.08 g/mL at 25 °C
屈折率
20 · n20/D 1.466(lit.)
闪点
54 °C · 54 °C
LogP
-0.388 · -0.388 (est)

化学的性質

化学的特性Colorless viscous liquid

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P332+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 79 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 4 件

Chemical: 2H-Pyran-2-carboxaldehyde, 3,4-dihydro-

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2H-Pyran-2-carboxaldehyde, 3,4-dihydro-: HSNO Approval: HSR001240 Approved with controls

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.)

DOT LabelFlammable Liquid
Fire Hazards · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

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

Health Hazards · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

· May cause toxic effects if inhaled or absorbed through skin.

Hazards Summary · 1 件

A mild skin irritant; Causes respiratory depression and lung changes in inhalation lethal-concentration studies of rats; Causes changes in bladder weight, changes in platelet count, and effects on other proteins in 9-day intermittent inhalation studies of rats; [RTECS] May cause eye and mucous membrane irritation; [CAMEO] May polymerize; An irritant that may cause serious eye injury; Harmful by ingestion, inhalation, and skin absorption; Inhalation of high concentrations may cause weakness, dizziness, and unconsciousness; [Sigma-Aldrich MSDS] Acrolein dimer, stabilized (UN2607) has warning of explosive polymerization; [ERG 2016]

DOT ID and Guide2607 129P

安全と保護具

Fire FightingExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:
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 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

Immediate precautionary measure

毒性情報

Adverse EffectsNeurotoxin - Other CNS neurotoxin
Toxicity DataLC50 (rat) = 3,225 ppm/4hr

安全データ

tsca
TSCA listed
rtecs
UP6825000
ridadr
UN 2607
risk_code
10-20/21/22-36/37/38-41
hazard_code
Xn
safety_code
16-26-33-36/37/39-45

化学と産業

用途と製造

UsesUsed to make other chemicals and plastics; [CAMEO]
General Manufacturing Information2H-Pyran-2-carboxaldehyde, 3,4-dihydro-: ACTIVE
応用分野 · 2 件

使用NSC 95413 is used as a reagent in chemical processes.

一般的な説明A colorless or yellow liquid with a pungent disagreeable odor. Flash point 118°F. Density 1.077 g / cm3 (8.96 lb / gal). May be irritating to the eyes and mucous membranes; long-term exposure may result in adverse health effects. Vapors denser than air. Used to make other chemicals, plastics.

サプライヤー50 社

Wuhan Godbullraw Chemical Co.,ltd+86-18986288449 · [email protected]
湖北成丰化工有限公司13125175253 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

関連反応

12 件

関連ノート

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