基本情報
- CAS
96077-04-2- 標準SMILES
CCCOCC(C)OCC(C)OCC(C)O- InChIKey
JKEHLQXXZMANPK-UHFFFAOYSA-N- 分子式
- C12H26O4
- 平均分子量
- 234.33 g/mol
- 単同位体質量
- 234.18310931
概要
See also: Tripropylene glycol propyl ether (annotation moved to).
名称と識別子
- 優先名称
- Propanol, 1(or 2)-(methyl-2-(methyl-2-propoxyethoxy)ethoxy)-
- IUPAC
- 1-[1-(1-propoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
- 英語名
- Tri(propylene glycol) propyl ether
- 分子式
- C12H26O4
- 分子量
- 234.33
名称と別名
Tripropylene glycol monopropyl etherTri(propylene glycol) propyl etherPropanol, 1(or 2)-[methyl-2-(methyl-2-propoxyethoxy)ethoxy]-Propanol, 1(or 2)-(methyl-2-(methyl-2-propoxyethoxy)ethoxy)-RefChem:869564DTXSID40894728Propanol, 1(or 2)-methyl-2-(methyl-2-propoxyethoxy)ethoxy-629-381-796077-04-21-[1-(1-propoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol1-(1-(1-Propoxypropan-2-yloxy)propan-2-yloxy)propan-2-olSCHEMBL55748
名称をさらに表示
tri(propylene glycol) propyl ether, mixturetri(propylene glycol) propyl ether, mixture of isomersTRI(PROPYLENE GLYCOL) PROPYL ETHER ISO 9001：2015 REACHTri(propylene glycol) propyl ether, mixture of isomers 97%TRI(PROPYLENE GLYCOL) PROPYL ETHER, 97%, MIXTURE OF ISOMERS
Tripropylene glycol mono-n-propyl etherTri-propylene glycol mono-n-propyl etherTripropylene glycol monopropyl ether, Tripropylene glycol n -propyl ether
物性
構造計算による物性
- XLogP
- 1.3
- 極性表面積
- 47.9 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 4
- 回転可能結合数
- 10
- 重原子数
- 16
- 形式電荷
- 0
- 複雑度
- 152
実験および物理化学的性質
Physical DescriptionLiquid
物理化学的性質
- 沸点
- 261 °C · 261 °C(lit.)
- 比重(密度)
- 0.935 g/mL · 0.935 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.43(lit.)
- 闪点
- 230 °F · >230 °F
- 溶解性
- 2 O: · H2O: 可溶
- 水溶解度
- 2 O: · H2O: soluble
- InChI
- 1S/C12H26O4/c1-5-6-14-8-11(3)16-9-12(4)15-7-10(2)13/h10-13H,5-9H2,1-4H3
- InChIKey
- JKEHLQXXZMANPK-UHFFFAOYSA-N
- SMILES
- CCCOCC(C)OCC(C)OCC(C)O
- EPAの化学物質情報
- 1 · Propanol, 1(or 2)-[methyl-2-(methyl-2-propoxyethoxy)ethoxy]- (96077-04-2)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Propanol, 1(or 2)-[methyl-2-(methyl-2-propoxyethoxy)ethoxy]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanol, 1(or 2)-[methyl-2-(methyl-2-propoxyethoxy)ethoxy]- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Propanol, 1(or 2)-methyl-2-(methyl-2-propoxyethoxy)ethoxy-: 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.
Hazard Classes and CategoriesEye Irrit. 2 (100%)
安全データ
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2
- ストレージクラス
- 10 - Combustible liquids
化学と産業
用途と製造
U.S. Production2023: 1,000,000 - <5,000,000 lb
Industry UsesIntermediate
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Propanol, 1(or 2)-[methyl-2-(methyl-2-propoxyethoxy)ethoxy]-: ACTIVE
応用分野
使用Cosolvent in water-based coatings and cleaners.
サプライヤー16 社
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