基本情報
- 標準SMILES
CCO[Si](C)(CCCN)OCC- InChIKey
HXLAEGYMDGUSBD-UHFFFAOYSA-N- 分子式
- C8H21NO2Si
- 平均分子量
- 191.34 g/mol
- 単同位体質量
- 191.13415544
名称と識別子
- 優先名称
- 3-(Diethoxymethylsilyl)propylamine
- IUPAC
- 3-[diethoxy(methyl)silyl]propan-1-amine
- 現地名
- 3-アミノプロピルジエトキシメチルシラン
- 英語名
- 3-Aminopropyl-methyl-diethoxysilane
- 分子式
- C8H21NO2Si
- 分子量
- 191.34
名称と別名
名称をさらに表示
データベース識別子
- CAS
3179-76-8- PubChem CID
- 18511
- DTXSID
DTXSID2038817- UNII
- A36TO38MQN
- EC Number
- 221-660-8
- Nikkaji
- J21.114A
物性
構造計算による物性
- 極性表面積
- 44.5 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 7
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 105
実験および物理化学的性質
物理化学的性質
- 融点
- -20 °C · <-20°C
- 沸点
- 85 · 85-88 °C8 mm Hg(lit.)
- 比重(密度)
- 0.916 g/mL · 0.916 g/mL at 25 °C(lit.)
- 蒸気圧
- 6.9 Pa · 6.9Pa at 25℃
- 屈折率
- 20 · n20/D 1.426(lit.)
- 闪点
- 168 °F · 168 °F
- 貯蔵温度
- Keep in dark place,Inert atmosphere,Room temperature
- 外見
- 液体
- 酸解離定数(Pka)
- 10.52 · 10.52±0.10(Predicted)
- 比重
- 0.916 · 0.916
- 色
- Colorless to Almost colorless
- 水溶解度
- 水溶性で水と反応します。
- BRN
- 1744264 · 1744264
- InChI
- 1S/C8H21NO2Si/c1-4-10-12(3,11-5-2)8-6-7-9/h4-9H2,1-3H3
- InChIKey
- HXLAEGYMDGUSBD-UHFFFAOYSA-N
- SMILES
- CCO[Si](C)(CCCN)OCC
- LogP
- 2.5 at · 2.5 at 20℃
- CAS データベース
- 3179 · 3179-76-8(CAS DataBase Reference)
- NISTの化学物質情報
- 1 · 1-Propanamine, 3-(diethoxymethylsilyl)-(3179-76-8)
- EPAの化学物質情報
- 1 · 1-Propanamine, 3-(diethoxymethylsilyl)- (3179-76-8)
化学的性質
化学的特性Colorless transparent liquid
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 1.7% (5 of 299) of reports.
Danger
H314 (91%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 299 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: 1-Propanamine, 3-(diethoxymethylsilyl)-
1-Propanamine, 3-(diethoxymethylsilyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanamine, 3-(diethoxymethylsilyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 13-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/5328
1-Propanamine, 3-(diethoxymethylsilyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
安全と保護具
Protective Action Criteria (PAC)
13 [mg/m3]
140 [mg/m3]
860 [mg/m3]
毒性情報
安全データ
- F
- 10-21-34
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- UI0700000
- ridadr
- UN 3267 8/PG 2
- 毒性
- LD50 oral in rat: 4760uL/kg
- hs_code
- 29319090
- risk_code
- 34
- 消防法
- 危-4-3-III
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- packing_group
- III
- Hazard Classifications
- Skin Corr. 1B
- ストレージクラス
- 8A - Combustible corrosive hazardous materials
化学と産業
用途と製造
Uses
Used to formulate coatings, paints, thinners, paint removers, adhesives, and sealants, in polymer preparations and compounds, as a chemical intermediate, and as a laboratory reagent; [ExPub: ECHA REACH Registrations]
Painting (Pigments, Binders, and Biocides) [Category: Paint]
General Manufacturing Information
All Other Basic Inorganic Chemical Manufacturing
1-Propanamine, 3-(diethoxymethylsilyl)-: ACTIVE
応用分野
使用(3-Aminopropyl)diethoxymethylsilane is used as silane coupling agent. The aromatic imine monolayers were prepared by reacting (3-aminopropyl)diethoxymethylsilane.
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