4-ブロモ-2-メチルベンゾトリフルオリド

4-Bromo-2-methyl-1-(trifluoromethyl)benzene

HCID 45790478

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 936092-88-5
標準SMILES: Cc1cc(Br)ccc1C(F)(F)F
InChIKey: NJDGQPXHSKERCP-UHFFFAOYSA-N
分子式: C8H6BrF3
平均分子量: 239.03 g/mol
単同位体質量: 237.96049695

名称と識別子

優先名称: 4-Bromo-2-methyl-1-(trifluoromethyl)benzene
IUPAC: 4-bromo-2-methyl-1-(trifluoromethyl)benzene
現地名: 4-ブロモ-2-メチルベンゾトリフルオリド
英語名: 4-Bromo-2-methylbenzotrifluoride
分子式: C8H6BrF3
分子量: 239.03

名称と別名

936092-88-54-bromo-2-methyl-1-(trifluoromethyl)benzeneDTXSID60672303RefChem:98089DTXCID60623052690-057-34-Bromo-2-methylbenzotrifluorideMFCD111005264-BROMO-2-METHYL-TRIFLUOROMETHYLBENZENE5-Bromo-2-(trifluoromethyl)toluene5-bromo-2-trifluoromethyltolueneAKOS005255455

名称をさらに表示

4-ブロモ-2-メチルベンゾトリフルオリド4-Bromo-2-methyl-1-(trifluoromethyl)3-Methyl-4-trifluoromethylphenyl bromideBenzene, 4-bromo-2-methyl-1-(trifluoromethyl)-5-Bromo-2-(trifluoromethyl)toluene, 4-Bromo-2-methyl-1-(trifluoromethyl)benzene

AS-30470SY104295EN300-135788Z1269149151SCHEMBL869450SCHEMBL294269884-Bromo-2-methyl-1-trifluoromethyl-benzeneCS-0059221

データベース識別子

CAS: 936092-88-5
PubChem CID: 45790478
DTXSID: DTXSID60672303
EC Number: 690-057-3

物性

構造計算による物性

XLogP: 3.9
極性表面積: 0 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: 0
重原子数: 12
形式電荷: 0
複雑度: 155

物理化学的性質

沸点: 202.4 · 202.4±35.0 °C(Predicted)
比重(密度): 1.538 · 1.538±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C
外見: liquid
色: Clear, colourless

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H226 (33.3%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 3 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

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

安全データ

hs_code: 2903998090
hazard_code: Xi
hazard_class: IRRITANT

化学と産業

サプライヤー49 社

上海策嵘生物科技有限公司[email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

安徽合诺生物科技有限公司0555-2761852

化合物ノート

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