tridodecylamine

• ChemBase ID: 104740
• Molecular Formular: C36H75N
• Molecular Mass: 521.9874
• Monoisotopic Mass: 521.58995141
• SMILES: CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC
• Canonical SMILES: CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC
• InChI: InChI=1S/C36H75N/c1-4-7-10-13-16-19-22-25-28-31-34-37(35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3/h4-36H2,1-3H3
• InChIKey: SWZDQOUHBYYPJD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tridodecylamine
• IUPAC Traditional name: tridodecylamine
• Synonyms: TRIDODECYLAMINE TECHNICAL GRADE; Proton ionophore I; Tridodecylamine; Hydrogen ionophore I; Hydrogen ionophore I; Tridodecylamine; TRIDODECYLAMINE; Tri-n-dodecylamine; 三月桂胺; 质子离子载体 I; 氢离子载体 I; 氢离子载体 I; 三月桂胺; 三正十二胺

Database IDs

• CAS Number: 102-87-4
• EC Number: 203-063-4
• MDL Number: MFCD00008971
• Beilstein Number: 1801669
• PubChem SID: 162093044; 24889507; 24890119; 24858478
• PubChem CID: 7624

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 11.336615
• LogD (pH = 7.4): 11.671769
• Log P: 14.831514
• Molar Refractivity: 172.0329 cm^3
• Polarizability: 68.75331 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 33
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 14-16°C; 32°C
• Boiling Point: 164°C; 220-228 °C/0.03 mmHg(lit.); 220-228°C/0.03m
• Flash Point: 113 °C; 190°C(374°F); 235.4 °F
• Density: 0.823; 0.823 g/mL at 25 °C(lit.)
• Refractive Index: 1.4578; n20/D 1.4578(lit.); n20/D 1.458
• Vapor Density: >1 (vs air)

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 2
• Risk Statements: 36/37/38; 36/38; R:36/37/38
• Safety Statements: 26-36; 26-37; S:20-25-26-37/39
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319; H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P280-P305+P351+P338-P302+P352-P321-P362-P332+P313
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• Storage Temperature: 2-8°C

Product Information

• Purity: >85%; ≥97.0% (GC); ≥97.0% (NT); 85%; 95%
• Grade: Selectophore™; TECHNICAL; technical grade
• Quality: function tested
• Linear Formula: [CH3(CH2)11]3N

DETAILS

MP Biomedicals - 02157002

Purity: >85%
Yellow liquid

MP Biomedicals - 05219268

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 306134

Packaging
10, 25 g in glass bottle

Sigma Aldrich - 91660

Caution
may form precipitate on storage
Packaging
10 mL in glass bottle

Sigma Aldrich - 95292

General description
Visit our Sensor Applications portal to learn more.
Legal Information
Selectophore is a trademark of Sigma-Aldrich GmbH