基本情報
- 標準SMILES
CC(C)(C)OC(C)(C)C- InChIKey
AQEFLFZSWDEAIP-UHFFFAOYSA-N- 分子式
- C8H18O
- 平均分子量
- 130.23 g/mol
- 単同位体質量
- 130.13576519
名称と識別子
- 優先名称
- Di-tert-butyl ether
- IUPAC
- 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane
- 現地名
- ジtert-ブチルエーテル
- 英語名
- Di-tert-butyl ether
- 分子式
- C8H18O
- 分子量
- 130.23
名称と別名
名称をさらに表示
データベース識別子
- CAS
6163-66-2- PubChem CID
- 22541
- DTXSID
DTXSID80210645- UNII
- C3A9UPP65H
- EC Number
- 672-143-2
- Nikkaji
- J44.185F
物性
構造計算による物性
- XLogP
- 2
- 極性表面積
- 9.2 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 2
- 重原子数
- 9
- 形式電荷
- 0
- 複雑度
- 69
物理化学的性質
- 融点
- -78.15 °C · -78.15°C
- 沸点
- 106 °C · 106°C
- 比重(密度)
- 420 · d420 0.7658
- 屈折率
- 20 · nD20 1.3949
- 貯蔵温度
- Sealed in dry,Room Temperature
- 溶解性
- Chloroform (Sparingly), Methanol (Slightly)
- 外見
- Liquid
- 色
- Colourless
- 比熱容量
- 2.12 J/ · Cp(liquid): 2.12 J/(g·K), at 25℃
- Henry's Law Constant
- 2.1 · 2.1×10-3 mol/(m3Pa) at 25℃, Yaws (2003)
- Dielectric constant
- 3.05 · 3.0499999999999998
- 安定性
- Volatile
安全と法規制
GHS分類
GHS Classification
Warning
H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids];H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (66.7%): 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 3 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
Peroxide Forming Chemical
t-Butyl ether
B*: Compounds that form peroxides on concentration (distillation/evaporation)
Moderate peroxides found in new commerically available containers
Bretherick's
An explosion occured druing distillation despite a negative test result for peroxides. See Bretherick's.
Bowen, R. D. et al., J. Chem. Soc. Perk. 2, 1990, 147
安全データ
- ridadr
- 3271
- risk_code
- 10-36/37/38
- safety_code
- 16-26-36
化学と産業
応用分野
使用Gasoline additive.
上流・下流製品情報
下流製品
サプライヤー33 社
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