1-[4-(2,4,4-trimethylpentan-2-yl)phenyl]-1,4,7,10,13,16,19-heptaoxahenicosan-21-ol

• ChemBase ID: 103604
• Molecular Formular: C28H50O8
• Molecular Mass: 514.6918
• Monoisotopic Mass: 514.35056856
• SMILES: CC(C)(C)CC(C)(C)c1ccc(OCCOCCOCCOCCOCCOCCOCCO)cc1
• Canonical SMILES: OCCOCCOCCOCCOCCOCCOCCOc1ccc(cc1)C(CC(C)(C)C)(C)C
• InChI: InChI=1S/C28H50O8/c1-27(2,3)24-28(4,5)25-6-8-26(9-7-25)36-23-22-35-21-20-34-19-18-33-17-16-32-15-14-31-13-12-30-11-10-29/h6-9,29H,10-24H2,1-5H3
• InChIKey: HNLXNOZHXNSSPN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-[4-(2,4,4-trimethylpentan-2-yl)phenyl]-1,4,7,10,13,16,19-heptaoxahenicosan-21-ol
• IUPAC Traditional name: 1-[4-(2,4,4-trimethylpentan-2-yl)phenyl]-1,4,7,10,13,16,19-heptaoxahenicosan-21-ol
• Synonyms: Polyethylene glycol 4-tert-octylphenyl ether; Triton™ X-305 solution; 4-(1,1,3,3-Tetramethylbutyl)phenyl-polyethylene glycol solution; Triton™ X-100 solution; 4-(1,1,3,3-Tetramethylbutyl)phenyl-polyethylene glycol; t-Octylphenoxypolyethoxyethanol; Polyethylene glycol tert-octylphenyl ether; (1,1,3,3-Tetramethylbutyl)phenyl-polyethylene glycol; (1,1,3,3-Tetramethylbutyl)phenyl-polyethylene glycol solution; Triton™ X-114 solution; Triton™ X-165 solution; Triton™ X-114, reduced; Polyoxyethylene (40) isooctylcyclohexyl ether; Triton™ X-405, reduced; TRITON® X-405; Triton™ X-405 solution; Triton™ X-100; Triton™ X-114; Triton™ X-705 solution; Triton™ X-45; Polyoxyethylene (2) isooctylphenyl ether; Polyoxyethylene (2) octylphenyl ether, branched; IGEPAL® CA-210; Polyoxyethylene (12) isooctylphenyl ether; Polyoxyethylene (12) octylphenyl ether, branched; IGEPAL® CA-720; Polyoxyethylene (5) isooctylphenyl ether; Polyoxyethylene (5) octylphenyl ether, branched; IGEPAL® CA-520; Triton™ X-305 溶液; 4-(1,1,3,3-四甲基丁基)苯基-聚乙二醇溶液; 4-(1,1,3,3-四甲基丁基)苯基-聚乙二醇溶液; Triton™ X-100 溶液; (1,1,3,3-四甲基丁基)苯基-聚乙二醇 溶液; Triton™ X-114 溶液; Triton™ X-165 溶液; Triton™ X-114，还原型; 聚氧代乙烯(40)异辛基环己基醚; Triton™ X-405，还原型; 聚氧乙烯 (40) 异辛基苯基醚; Triton™ X-405 溶液; 4-(1,1,3,3-四甲基丁基)苯基-聚乙二醇; 叔辛基苯氧基聚乙烯乙氧基乙醇; (1,1,3,3-四甲基丁基)苯基-聚乙二醇; 聚乙二醇叔辛基苯基醚; Triton™ X-705 溶液; 聚乙二醇 4-叔辛基苯基醚; 支链聚氧乙烯 (2) 辛基苯基醚; 聚氧乙烯 (2) 异辛基苯基醚; 支链聚氧乙烯 (12) 辛基苯基醚; 聚氧乙烯 (12) 异辛基苯基醚; 支链聚氧乙烯 (5) 辛基苯基醚; 聚氧乙烯 (5) 异辛基苯基醚; Triton™ X-100

Database IDs

• CAS Number: 92046-34-9; 9036-19-5; 9002-93-1
• MDL Number: MFCD00128254
• Beilstein Number: 2315025
• PubChem SID: 24854314; 24889888; 24854313; 24858296; 24877842; 162103267; 24854315; 24902129; 24902148; 24889882; 24889881; 24902154; 24889879; 24858093
• PubChem CID: 75622

CALCULATED PROPERTIES

• Acid pKa: 15.121156
• H Acceptors: 8
• H Donor: 1
• LogD (pH = 5.5): 3.8648794
• LogD (pH = 7.4): 3.8648794
• Log P: 3.8648794
• Molar Refractivity: 141.9661 cm^3
• Polarizability: 56.230316 Å^3
• Polar Surface Area: 84.84 Å^2
• Rotatable Bonds: 24
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Solubility: H2O: soluble0.005 M at 20 °C, clear, colorless
• Apperance: APHA: ≤100
• Melting Point: -4°C; 48-50 °C(lit.)
• Boiling Point: 100°C
• Flash Point: > 100°C; 113 °C; 200 °F; 235.4 °F; 251 °C; 483.8 °F; 93 °C
• Density: 1.006 g/mL at 20 °C; 1.009 g/mL at 25 °C(lit.); 1.01 g/mL at 20 °C; 1.035-1.039 g/mL at 20 °C; 1.044 g/mL at 25 °C(lit.); 1.058 g/mL at 25 °C(lit.); 1.06 g/mL at 20 °C; 1.06 g/mL at 25 °C(lit.); 1.065 g/mL at 20 °C; 1.08 g/mL at 20 °C; 1.096 g/mL at 25 °C; 1.1 g/ml; 1.10 g/mL at 20 °C; 1.104 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.348; n20/D 1.349; n20/D 1.349±0.002; n20/D 1.441; n20/D 1.487(lit.); n20/D 1.488(lit.); n20/D 1.490-1.494; n20/D 1.495; n20/D 1.497(lit.); n20/D 1.500; n20/D 1.509(lit.)
• Vapor Pressure: 17 mm Hg @ 20°C
• Critical Micelle Concentration: 0.2; 0.2 mM(20-25°C); 0.2-0.9; 0.2-0.9 mM(20-25°C)
• Aggregation Number of Micelle: 100-155
• Transition Temperature: cloud point 23 °C; cloud point 34 °C; cloud point 63-69 °C (1%; demin. water); cloud point 65 °C; pour point ~-26 °C; pour point ~7 °C; pour point ~-9 °C
• Turbidity: ≤5.0 NTU
• pH: 6.5-8.5 (25 °C)
• Hydrophilic Lipophilic Balance: 10; 12.4; 13.5; 14; 4

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: MD0907700
• European Hazard Symbols: Nature polluting (N); Irritant (Xi); Harmful (Xn)
• UN Number: 3082
• German water hazard class: -; 1; 3
• Hazard Class: 9
• Packing Group: 3
• Risk Statements: 22-36-51/53; 22-41-51/53; 36/37/38; 41; 41-52/53
• Safety Statements: 26-36/37; 26-39; 26-39-61
• GHS Pictograms: GHS05; GHS07; GHS09
• GHS Signal Word: Danger; Warning
• GHS Hazard statements: H302-H318-H411; H302-H319-H411; H315-H319-H335; H318; H318-H412
• GHS Precautionary statements: P261-P305 + P351 + P338; P273-P280-P305 + P351 + P338; P273-P305 + P351 + P338; P280-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves; Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter; Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter, type N95 (US), type P1 (EN143) respirator filter; Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3082 9/PG 3
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥99%
• Concentration: ~10% in H2O; ~70% in H2O; 70% in H2O
• Grade: CP; for electrophoresis; for molecular biology; laboratory grade
• Compostion: t-Oct-C6H4-(OCH2CH2)xOH, x = 7-8
• Ignition Residue: ≤0.2%; ≤0.4%
• Description: non-ionic
• Impurities: ≤0.001% peroxides (as H2O2); ≤0.05% Phosphorus (P); ≤1% water; ≤150 μM sulfhydryl oxidizing substances (carbonyls, peroxides); DNases, none detected; insoluble matter, passes filter test; phosphatases, none detected; proteases, none detected; RNases, none detected
• Cation Traces: Al: ≤0.0005%; Al: ≤1 mg/kg; Ba: ≤1 mg/kg; Bi: ≤1 mg/kg; Ca: ≤0.0005%; Ca: ≤10 mg/kg; Ca: ≤5 mg/kg; Cd: ≤1 mg/kg; Cd: ≤5 mg/kg; Co: ≤1 mg/kg; Co: ≤5 mg/kg; Co: ≤50 mg/kg; Cr: ≤1 mg/kg; Cr: ≤5 mg/kg; Cu: ≤0.0005%; Cu: ≤1 mg/kg; Cu: ≤5 mg/kg; Fe: ≤0.0005%; Fe: ≤1 mg/kg; Fe: ≤5 mg/kg; K: ≤0.005%; K: ≤100 mg/kg; K: ≤500 mg/kg; Li: ≤1 mg/kg; Mg: ≤0.0005%; Mg: ≤1 mg/kg; Mg: ≤5 mg/kg; Mg: ≤50 mg/kg; Mn: ≤1 mg/kg; Mn: ≤5 mg/kg; Mo: ≤1 mg/kg; Na: ≤0.1%; Na: ≤100 mg/kg; Na: ≤500 mg/kg; NH4+: ≤0.05%; Ni: ≤1 mg/kg; Ni: ≤5 mg/kg; Pb: ≤0.001%; Pb: ≤1 mg/kg; Pb: ≤5 mg/kg; Sr: ≤1 mg/kg; Zn: ≤0.0005%; Zn: ≤1 mg/kg; Zn: ≤5 mg/kg
• Antion Traces: chloride (Cl-): ≤0.05%; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤0.05%; sulfate (SO42-): ≤50 mg/kg
• Foreign Activity: DNase and RNase, none detected
• Quality: ampule
• Mol. Weight: average Mn ~294; average Mn ~427; average Mn ~735; average mol wt 537; average mol wt 625; average mol wt 80,000; micellar avg mol wt 80,000
• Product Line: BioUltra; BioXtra
• abs.: 1%/278 nm, ethanol <0.25; absorption/310 nm cut-off
• Linear Formula: (C2H4O)n · C14H22O n~1.5; (C2H4O)n · C14H22O, n~12.5; (C2H4O)n · C14H22O, n~5; (C2H4O)n C14H22O, n = 7 or 8; t-Oct-C6H4-(OCH2CH2)xOH, x= ~5; t-Oct-C6H4-(OCH2CH2)xOH, x= 9-10
• Empirical Formula (Hill Notation): C30H60O9

DETAILS

Sigma Aldrich - 93443

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - T8787

Biochem/physiol Actions
广泛使用的非离子表面活性剂，用于在温和的非变性条件下进行膜恢复。
包装
50, 100, 250 mL in poly bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93427

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93428

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93426

Biochem/physiol Actions
Widely used non-ionic surfactant for recovery of membrane components under mild non-denaturing conditions.
Other Notes
In mRNA translation. Can be substituted for microsomes if they are only being used to maximize translation1
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93422

Other Notes
Phase separation of integral membrane proteins1,2; Solubilization of phosphatidylinositol 4-phosphate 5-kinase from bovine brain3
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - T8532

Application
等电聚焦 (IEF) 和二维电泳的洗涤剂。通常将介于 1-4% (v/v) 间的浓度用于等电聚焦凝胶。也用于细胞透化和包括高分子量蛋白质在内的蛋白质增溶。
Biochem/physiol Actions
广泛使用的非离子表面活性剂，用于在温和的非变性条件下进行膜恢复。
包装
1, 100, 500 mL in glass bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - X45

包装
1 L in poly bottle
100 mL in poly bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 303127

Packaging
5, 25 g in glass bottle
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 531812

Packaging
5 g in glass bottle
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 300411

Packaging
5, 25 g in glass bottle
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93445

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93419

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93444

Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 93420

Biochem/physiol Actions
Widely used non-ionic surfactant for recovery of membrane components under mild non-denaturing conditions.
Caution
may become turbid on storage
Other Notes
Non-ionic detergent used in the preparation of acetylcholine-receptor protein1
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 238589

Packaging
100, 500 g in poly bottle
Legal Information
IGEPAL is a registered trademark of Rhodia Operations

Sigma Aldrich - X405

包装
1 L in poly bottle
1, 5 gal in poly bottle
100, 500 mL in poly bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - X70570

包装
1 gal in poly bottle
100, 500 mL in poly bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 30-5140

Biochem/physiol Actions
Widely used non-ionic surfactant for recovery of membrane components under mild non-denaturing conditions.
Legal Information
Triton is a trademark of The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 238562

Packaging
100, 500 g in poly bottle
Legal Information
IGEPAL is a registered trademark of Rhodia Operations

Sigma Aldrich - T9284

Biochem/physiol Actions
广泛使用的非离子表面活性剂，用于在温和的非变性条件下进行膜恢复。
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - X100PC

Biochem/physiol Actions
广泛使用的非离子表面活性剂，用于在温和的非变性条件下进行膜恢复。
包装
氩气保护下安瓿包装。
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - X114

Application
低浊点 (23°C) 的非离子型洗涤剂利用两亲性蛋白质中亲水蛋白质的相分配使蛋白质增溶。
包装
1 L in poly bottle
100, 500 mL in poly bottle
5 gal in poly drum
1 gal in poly bottle
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - X100

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Biochem/physiol Actions
广泛使用的非离子表面活性剂，用于在温和的非变性条件下进行膜恢复。
法律信息
Triton 商标 The Dow Chemical Company or an affiliated company of Dow

Sigma Aldrich - 238570

Packaging
100 g in poly bottle
Legal Information
IGEPAL is a registered trademark of Rhodia Operations