基本情報
- 標準SMILES
C=CC(=O)OCCCl- InChIKey
WHBAYNMEIXUTJV-UHFFFAOYSA-N- 分子式
- C5H7ClO2
- 平均分子量
- 134.56 g/mol
- 単同位体質量
- 134.01345714
概要
Insoluble in water (<1 mg/mL at 70 °F). (NTP, 1992)
名称と識別子
- 優先名称
- 2-Chloroethyl acrylate
- IUPAC
- 2-chloroethyl prop-2-enoate
- 現地名
- アクリル酸2-クロロエチル
- 英語名
- 2-Chloroethyl acrylate
- 分子式
- C5H7ClO2
- 分子量
- 134.56
名称と別名
名称をさらに表示
データベース識別子
- CAS
2206-89-5- PubChem CID
- 16627
- DTXSID
DTXSID8024783- ChEMBL
CHEMBL450171- UNII
- XA9Y3IT710
- EC Number
- 218-619-1
- Nikkaji
- J33.793E
物性
構造計算による物性
- XLogP
- 1.1
- 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
- 4
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 90.4
実験および物理化学的性質
物理化学的性質
- 沸点
- 64 · 64-66°C 20mm
- 比重(密度)
- 1.125 g/mL · 1.125 g/mL at 25 °C
- 屈折率
- 20 · n20/D1.125
- 闪点
- 59 ℃ · 59℃
- 貯蔵温度
- 2 · 2-8°C
- 外見
- liquid
- InChI
- 1S/C5H7ClO2/c1-2-5(7)8-4-3-6/h2H,1,3-4H2
- InChIKey
- WHBAYNMEIXUTJV-UHFFFAOYSA-N
- SMILES
- ClCCOC(=O)C=C
- EPAの化学物質情報
- 2 · 2-Chloroethyl acrylate (2206-89-5)
安全と法規制
GHS分類
GHS Classification
Danger
H226 (97.5%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P273, P280, P301+P316, P303+P361+P353, P305+P354+P338, P317, P321, P330, P370+P378, P391, 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.
危険有害性情報
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: Should a spill occur while you are handling this chemical, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: When working with this chemical, wear a NIOSH-approved full face chemical cartridge respirator equipped with the appropriate organic vapor cartridges. If that is not available, a half face respirator similarly equipped plus airtight goggles can be substituted. However, please note that half face respirators provide a substantially lower level of protection than do full face respirators. (NTP, 1992)
安全データ
- wgk
- 3
- rtecs
- AS6300000
- ridadr
- UN 1992 6.1(3) / PGIII
- 毒性
- rat,LCLo,inhalation,250ppm/4H (250ppm),AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951.
- risk_code
- 36/37/38-50-36-25-10
- hazard_code
- T,N
- safety_code
- 26-36/37/39-61-45
- Hazard Classifications
- Acute Tox. 3 OralAquatic Acute 1Eye Dam. 1Flam. Liq. 3
- ストレージクラス
- 3 - Flammable liquids
化学と産業
応用分野
一般的な説明Insoluble in water (<1 mg/mL at 70°F) .
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