기본 정보
- 표준 SMILES
C=CCOCC=C- InChIKey
ATVJXMYDOSMEPO-UHFFFAOYSA-N- 분자식
- C6H10O
- 평균 분자량
- 98.14 g/mol
- 단동위원소 질량
- 98.07316494
개요
Diallyl ether appears as a liquid with an odor of radishes. Less dense than water. May be toxic by ingestion, skin absorption, and inhalation, and may irritate skin and eyes. Vapors heavier than air. Used to make other chemicals.
이름 및 식별자
- 우선 이름
- Diallyl ether
- IUPAC
- 3-prop-2-enoxyprop-1-ene
- 현지명
- 알릴 에테르
- 영어명
- Allyl ether
- 분자식
- C6H10O
- 분자량
- 98.14
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
557-40-4- PubChem CID
- 11194
- DTXSID
DTXSID8060321- UNII
- GI3WXY29NQ
- EC Number
- 209-174-4
- Nikkaji
- J6.485H
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 49.2
실험 및 물리화학적 성질
Flash Point
20 °F (NFPA, 2010)
-6 °C
Physical Description
Diallyl ether appears as a liquid with an odor of radishes. Less dense than water. May be toxic by ingestion, skin absorption, and inhalation, and may irritate skin and eyes. Vapors heavier than air. Used to make other chemicals.
COLOURLESS LIQUID WITH CHARACTERISTIC ODOUR.
물리화학적 성질
- 녹는점
- -6 °C · -6°C
- 끓는 점
- 94 °C · 94 °C
- 밀도
- 0.803 g/mL · 0.803 g/mL at 25 °C(lit.)
- 굴절률
- 1.415 · 1.415-1.417
- 인화점
- -7 °C · -7 °C
- 저장 조건
- Refrigerator (+4°C) + Flammables area
- 용해도
- 에 용해됨클로로포름, 메탄올 (약간 용해됨)
- 물리적 상태
- 투명한 액체
- 색상
- 무색 내지 거의 무색
- 냄새
- Pungent odor, reminiscent of Radish
- 수용성
- 불용성
- Merck
- 14 · 14,292
- InChI
- 1S/C6H10O/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H2
- InChIKey
- ATVJXMYDOSMEPO-UHFFFAOYSA-N
- SMILES
- C=CCOCC=C
- NIST
- 2 · (CH2=CHCH2)2O(557-40-4)
- EPA
- 1 · 1-Propene, 3,3'-oxybis- (557-40-4)
화학적 성질
clear colorless liquid
안전 및 규제
GHS 분류
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1-Propene, 3,3'-oxybis-
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 131 [Flammable Liquids - Toxic; polymerization hazard]:
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Highly flammable. Vapour/air mixtures are explosive. Risk of fire and explosion on contact with acids or oxidizing agents.
Health Hazards
Excerpt from ERG Guide 131 [Flammable Liquids - Toxic; polymerization hazard]:
· TOXIC; may be fatal if inhaled, ingested or absorbed through skin.
Reactivity Profile
Ethers, such as DIALLYL ETHER can act as bases. They form salts with strong acids and addition complexes with Lewis acids. The complex between diethyl ether and boron trifluoride is an example. Ethers may react violently with strong oxidizing agents. In other reactions, which typically involve the breaking of the carbon-oxygen bond, ethers are relatively inert.
DOT Hazard Classification
Diallylether
UN2360
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG II: the degree of danger presented by the material is medium
안전 및 보호
Fire Fighting
Excerpt from ERG Guide 131 [Flammable Liquids - Toxic; polymerization hazard]:
Use water spray, powder, alcohol-resistant foam, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.
First Aid Measures
Fresh air, rest. Refer for medical attention.
Remove contaminated clothes. Rinse and then wash skin with water and soap.
First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.
Rinse mouth. Refer for medical attention .
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 131 [Flammable Liquids - Toxic; polymerization hazard]:
General First Aid:
Spillage Disposal
Personal protection: filter respirator for organic gases and vapours adapted to the airborne concentration of the substance. Ventilation. Remove all ignition sources. Collect leaking and spilled liquid in sealable containers as far as possible. Absorb remaining liquid in sand or inert absorbent. Then store and dispose of according to local regulations. Do NOT wash away into sewer.
Isolation and Evacuation
Excerpt from ERG Guide 131 [Flammable Liquids - Toxic; polymerization hazard]:
Immediate precautionary measure
Fire Prevention
NO open flames, NO sparks and NO smoking. Closed system, ventilation, explosion-proof electrical equipment and lighting. Do NOT use compressed air for filling, discharging, or handling. Use non-sparking handtools. Prevent build-up of electrostatic charges (e.g., by grounding).
독성 정보
Signs and Symptoms
Cough. Drowsiness. Unconsciousness.
Dry skin. Redness. Pain.
Redness. Pain.
Dullness. Nausea. Drowsiness. Unconsciousness.
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- KN7525000
- ridadr
- UN 2360
- 독성
- LD50 orally in rats: 0.32 g/kg (Smyth)
- HS 번호
- 2909.19.1800
- risk_code
- 36/37/38-20/21/22-11
- hazard_code
- Xn-F,Xn,F
- safety_code
- 9-36/37/39-33-26-16-45
- 포장분류
- II
- 위험 등급
- 3
- 기존화학 물질
- KE-27724
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
용도 및 제조
응용 분야
일반 설명A liquid with an odor of radishes. Less dense than water. Flash point 20°F. May be toxic by ingestion, skin absorption, and inhalation, and may irritate skin and eyes. Vapors heavier than air. Used to make other chemicals.
상·하류 제품 정보
하류 제품
공급사38 곳
관련 반응
연결된 노트
불러오는 중…