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About This Item
線性公式:
ClC6H3(F)OCH3
CAS號碼:
分子量::
160.57
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22
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推薦產品
化驗
97%
折射率
n20/D 1.511 (lit.)
bp
189 °C (lit.)
密度
1.265 g/mL at 25 °C (lit.)
SMILES 字串
COc1cc(F)cc(Cl)c1
InChI
1S/C7H6ClFO/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
InChI 密鑰
XPZBNEWAZPZUHF-UHFFFAOYSA-N
一般說明
3-Chloro-5-fluoroanisole is also referred to as 1-chloro-3-fluoro-5-methoxybenzene (IUPAC name). Two rotational isomeric forms, i.e. cis and trans forms of 3-chloro-5-fluoroanisole (1-chloro-3-fluoro-5-methoxybenzene) have been identified by ab initio and density functional theory (DFT) calculations.[1]
訊號詞
Warning
危險聲明
危險分類
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
標靶器官
Respiratory system
儲存類別代碼
10 - Combustible liquids
水污染物質分類(WGK)
WGK 3
閃點(°F)
174.9 °F - closed cup
閃點(°C)
79.4 °C - closed cup
個人防護裝備
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Rotamers and isotopomers of 3-chloro-5-fluoroanisole studied by resonant two-photon ionization spectroscopy and theoretical calculations.
Zhang, Lijuan, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 104, 235-242 (2013)
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