基本情報
- CAS
3680-02-2- 標準SMILES
C=CS(C)(=O)=O- InChIKey
WUIJTQZXUURFQU-UHFFFAOYSA-N- 分子式
- C3H6O2S
- 平均分子量
- 106.15 g/mol
- 単同位体質量
- 106.00885043
概要
Methyl vinyl sulfone is a clear pale yellow liquid. (NTP, 1992)
名称と識別子
- 優先名称
- Methyl vinyl sulfone
- IUPAC
- 1-methylsulfonylethene
- 現地名
- ビニルメチルスルホン
- 英語名
- Methyl vinyl sulfone
- 分子式
- C3H6O2S
- 分子量
- 106.14
名称と別名
名称をさらに表示
データベース識別子
- CAS
3680-02-2- PubChem CID
- 19354
- DTXSID
DTXSID1031628- ChEMBL
CHEMBL163849- UNII
- T6N4PU5BSH
- EC Number
- 222-958-0
- Nikkaji
- J54.361F
物性
構造計算による物性
- XLogP
- 0.1
- 極性表面積
- 42.5 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
- 6
- 形式電荷
- 0
- 複雑度
- 125
実験および物理化学的性質
物理化学的性質
- 沸点
- 115 · 115-117 °C19 mm Hg(lit.)
- 比重(密度)
- 1.212 g/mL · 1.212 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.463(lit.)
- 闪点
- 230 °F · >230 °F
- 貯蔵温度
- 2 · 2-8°C
- 外見
- 液体
- 比重
- 1.212 · 1.212
- 色
- 無色透明~微黄色透明
- BRN
- 878198 · 878198
- 安定性
- 安定。強力な酸化剤とは相容れない。刺激性。
- InChI
- InChI=1S/C3H6O2S/c1-3-6(2,4)5/h3H,1H2,2H3
- InChIKey
- WUIJTQZXUURFQU-UHFFFAOYSA-N
- SMILES
- C=CS(C)(=O)=O
- CAS データベース
- 3680 · 3680-02-2(CAS DataBase Reference)
- NISTの化学物質情報
- Ethene, (methylsulfonyl)-(3680-02-2)
- EPAの化学物質情報
- Ethene, (methylsulfonyl)- (3680-02-2)
化学的性質
化学的特性light yellow liquid
安全と法規制
GHS分類
GHS Classification
Danger
H302 (97.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P354+P338, P316, P317, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 48 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
Reactivity Profile
METHYL VINYL SULFONE is incompatible with oxidizing agents (NTP, 1992). Can react exothermically with reducing agents to release hydrogen gas or hydrogen sulfide. In the presence of various catalysts (such as acids) or initiatiators, can undergo exothermic polymerization reactions.
安全と保護具
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you should spill this chemical, use absorbent paper to pick up all liquid spill material. Seal the absorbent paper, as well as any of your clothing which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Wash any surfaces you may have contaminated with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
安全データ
- wgk
- 3
- rtecs
- WR6825000
- ridadr
- UN 2810 6.1/PG 1
- hs_code
- 29309099
- risk_code
- 22-27-41
- 消防法
- 危-4-3-III
- hazard_code
- T+,T,Xi
- safety_code
- 26-28-36/37/39-45-28A
- hazard_class
- 6.1
- packing_group
- II
- Hazard Classifications
- Acute Tox. 2 DermalAcute Tox. 4 OralEye Dam. 1
- ストレージクラス
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
化学と産業
応用分野
使用Methyl vinyl sulfone has been used:as derivatization reagent in an improved method for detection of pseudouridine in nucleoside mixtures by capillary HPLC-mass spectrometryin preparation of methylsulfonylethyl cellulose via Michael addition to cotton fabricin Heck vinylation of aryl halides
一般的な説明Clear pale yellow liquid.
調製方法
純化方法Pass the sulfone through a column of alumina, then de-gas, distil it in a vacuum line and store it at -190o until required. [Beilstein 1 III 1866.]
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