CAS 57486-67-6 Methyl 2-fluorophenylacetate (HCID 2733230)

基本情報

CAS: 57486-67-6
標準SMILES: COC(=O)Cc1ccccc1F
InChIKey: TWXVEZBPKFIMBB-UHFFFAOYSA-N
分子式: C9H9FO2
平均分子量: 168.16 g/mol
単同位体質量: 168.05865769

名称と識別子

優先名称: Methyl 2-fluorophenylacetate
IUPAC: methyl 2-(2-fluorophenyl)acetate
現地名: 2-フルオロフェニル酢酸メチル
英語名: Methyl 2-fluorophenylacetate
分子式: C9H9FO2
分子量: 168.16

名称と別名

Methyl 2-FluorophenylacetateRefChem:814416805-323-8methyl 2-(2-fluorophenyl)acetate57486-67-6methyl (2-fluorophenyl)acetateMFCD008006052-Fluorophenylacetic acid methyl esterBenzeneacetic acid, 2-fluoro-, methyl ester(2-Fluoro-phenyl)-acetic acid methyl esterSCHEMBL661699SCHEMBL6959640

名称をさらに表示

2-フルオロフェニル酢酸メチル2‐フルオロフェニル酢酸メチル2-(2-フルオロフェニル)酢酸メチル(2-フルオロフェニル)酢酸メチル2-フルオロベンゼン酢酸メチルメチル 2-(2-フルオロフェニル)アセタートMethyl 2-fluorophenylacetate,99%2-Flurophenylacetic acid methyl ester2-FLUORO-PHENYLACETIC ACIDMETHYL ESTER2-(2-fluorophenyl)acetic acid methyl esterMETHYL 2-FLUOROPHENYLACETATE ISO 9001：2015 REACH

methyl2-(2-fluorophenyl)acetateSCHEMBL30874634DTXSID10369796TWXVEZBPKFIMBB-UHFFFAOYSA-NAB7523SBB017031AKOS008905707KE-0702

データベース識別子

CAS: 57486-67-6
PubChem CID: 2733230
DTXSID: DTXSID10369796
EC Number: 805-323-8
Nikkaji: J1.281.574C

物性

構造計算による物性

XLogP: 1.8
極性表面積: 26.3 Å²
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: 3
重原子数: 12
形式電荷: 0
複雑度: 159

物理化学的性質

沸点: 210 °C · 210°C (rough estimate)
比重(密度): 1.141 · 1.1410 (estimate)
屈折率: 1.489 · 1.489-1.491
貯蔵温度: Sealed in dry,Room Temperature
外見: 液体
色: 無色透明
InChIKey: TWXVEZBPKFIMBB-UHFFFAOYSA-N

化学的性質

化学的特性clear colorless liquid

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).；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.