基本情報
- CAS
395-45-9- 標準SMILES
C=Cc1ccccc1C(F)(F)F- InChIKey
VGWWQZSCLBZOGK-UHFFFAOYSA-N- 分子式
- C9H7F3
- 平均分子量
- 172.15 g/mol
- 単同位体質量
- 172.04998471
名称と識別子
- 優先名称
- o-(Trifluoromethyl)styrene
- IUPAC
- 1-ethenyl-2-(trifluoromethyl)benzene
- 現地名
- 1-エテニル-2-(トリフルオロメチル)ベンゼン
- 英語名
- 2-(Trifluoromethyl)styrene
- 分子式
- C9H7F3
- 分子量
- 172.15
名称と別名
395-45-91-ethenyl-2-(trifluoromethyl)benzeneo-(Trifluoromethyl)styreneEINECS 206-902-2DTXSID30192644RefChem:855181DTXCID70115135206-902-22-(Trifluoromethyl)styrene1-(trifluoromethyl)-2-vinylbenzeneMFCD00035984Benzene, ethenyl(trifluoromethyl)-
名称をさらに表示
1-ビニル-2-(トリフルオロメチル)ベンゼン2-(トリフルオロメチル)スチレン1-エテニル-2-(トリフルオロメチル)ベンゼンorthotrifluoroethylene2-Vinylbenzotrifluoride1-TRIFLUOROMETHYL-2-VINYL-BENZENE1-Vinyl-2-(trifluoromethyl)benzene
o-trifluoromethylstyrene2-Trifluoromethylstyrenea-trifluoromethylstyrene3JKL69Y4NVBENZENE, 1-ETHENYL-2-(TRIFLUOROMETHYL)-SCHEMBL165004SCHEMBL6371141-trifluoromethyl-2-vinyl-benz
データベース識別子
- CAS
395-45-9- PubChem CID
- 2778198
- DTXSID
DTXSID30192644- UNII
- 3JKL69Y4NV
- EC Number
- 206-902-2
- Nikkaji
- J213.635J
物性
構造計算による物性
- XLogP
- 3.6
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 3
- 回転可能結合数
- 1
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 160
物理化学的性質
- 沸点
- 61 °C40 · 61 °C40 mm Hg(lit.)
- 比重(密度)
- 1.175 g/mL · 1.175 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.47(lit.)
- 闪点
- 108 °F · 108 °F
- 貯蔵温度
- 2 · 2-8°C
- 外見
- liquid
- 色
- Clear
- InChI
- InChI=1S/C9H7F3/c1-2-7-5-3-4-6-8(7)9(10,11)12/h2-6H,1H2
- InChIKey
- VGWWQZSCLBZOGK-UHFFFAOYSA-N
- SMILES
- C1(C=C)=CC=CC=C1C(F)(F)F
安全と法規制
GHS分類
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
危険有害性情報
Hazard Classes and CategoriesFlam. Liq. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
安全データ
- wgk
- 3
- ridadr
- UN 1993 3/PG 3
- hs_code
- 2903998090
- risk_code
- 10-36/37/38
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 16-26-36/37/39
- hazard_class
- 3.2
- packing_group
- III
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
化学と産業
上流・下流製品情報
下流製品
サプライヤー75 社
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
山东中图化工有限公司17864755731 · [email protected]
Syntechem Co.,Ltd[email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
関連反応
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化合物ノート
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