tetradecan-1-amine

• ChemBase ID: 109520
• Molecular Formular: C14H31N
• Molecular Mass: 213.40264
• Monoisotopic Mass: 213.24565
• SMILES: CCCCCCCCCCCCCCN
• Canonical SMILES: CCCCCCCCCCCCCCN
• InChI: InChI=1S/C14H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3
• InChIKey: PLZVEHJLHYMBBY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetradecan-1-amine
• IUPAC Traditional name: tetradecylamine
• Synonyms: MYRISTYLAMINE; 1-Aminotetradecane; Myristylamine; Tetradecylamine; 1-十四胺; 肉豆蔻胺; 十四胺

Database IDs

• CAS Number: 2016-42-4
• EC Number: 217-950-9
• MDL Number: MFCD00008157
• Beilstein Number: 1633740
• PubChem SID: 24899927; 162096292
• PubChem CID: 16217

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 2.1201386
• LogD (pH = 7.4): 2.539915
• Log P: 5.144127
• Molar Refractivity: 69.8024 cm^3
• Polarizability: 28.1184 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 38-40 °C; 38-40 °C(lit.); 40°C
• Boiling Point: 162 °C/15 mmHg(lit.); 162°C
• Flash Point: 110 °C; 230 °F

Safety Information

• RTECS: XB7970000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36/37
• GHS Pictograms: GHS07; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335-H400
• GHS Precautionary statements: P261-P273-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥98.5% (GC); 95%; 97%
• Grade: puriss.
• Linear Formula: CH3(CH2)13NH2

DETAILS

MP Biomedicals - 05211413

MP Biomedicals Rare Chemical collection

Sigma Aldrich - T10200

Packaging
5, 25 g in glass bottle