tetratriacontane

• ChemBase ID: 151235
• Molecular Formular: C34H70
• Molecular Mass: 478.9196
• Monoisotopic Mass: 478.54775224
• SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
• InChI: InChI=1S/C34H70/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-34H2,1-2H3
• InChIKey: GWVDBZWVFGFBCN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetratriacontane
• IUPAC Traditional name: N-tetratriacontane
• Synonyms: Tetratriacontane; 三十四烷

Database IDs

• CAS Number: 14167-59-0
• EC Number: 238-013-0
• MDL Number: MFCD00009412
• Beilstein Number: 1788466
• PubChem SID: 24889066; 24857269; 24889067; 162245391; 24867975
• PubChem CID: 26519

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 15.579061
• LogD (pH = 7.4): 15.579061
• Log P: 15.579061
• Molar Refractivity: 158.2362 cm^3
• Polarizability: 63.545002 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 31
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 72-74 °C; 72-75 °C; 72-75 °C(lit.)
• Boiling Point: 285 °C/2 mmHg(lit.)

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: ≥97.0% (GC); ≥98.0% (GC); 98%
• Grade: analytical standard; purum
• Packaging: ampule of 1000 mg
• Shelf Life: (limited shelf life, expiry date on the label)
• Linear Formula: CH3(CH2)32CH3

DETAILS

Sigma Aldrich - 287261

Packaging
1 g in glass bottle
250 mg in glass bottle