[(dimethylamino)(methoxy)methyl]dimethylamine

• ChemBase ID: 152109
• Molecular Formular: C6H16N2O
• Molecular Mass: 132.20404
• Monoisotopic Mass: 132.12626314
• SMILES: CN(C)C(N(C)C)OC
• Canonical SMILES: COC(N(C)C)N(C)C
• InChI: InChI=1S/C6H16N2O/c1-7(2)6(9-5)8(3)4/h6H,1-5H3
• InChIKey: NCIMAYPZWJQYGN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(dimethylamino)(methoxy)methyl]dimethylamine
• IUPAC Traditional name: [(dimethylamino)(methoxy)methyl]dimethylamine
• Synonyms: Methoxy-bis(dimethylamino)methane; Bis(dimethylamino)methoxymethane; 甲氧基-双(二甲氨基)甲烷; 二(二甲基氨基)甲氧基甲烷

Database IDs

• CAS Number: 1186-70-5
• EC Number: 214-695-5
• MDL Number: MFCD00042835
• Beilstein Number: 1900972
• PubChem SID: 162246254; 24883605
• PubChem CID: 70908

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.6652612
• LogD (pH = 7.4): 0.8713068
• Log P: 0.87468165
• Molar Refractivity: 39.2896 cm^3
• Polarizability: 15.5262 Å^3
• Polar Surface Area: 15.71 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 120-125 °C(lit.)
• Flash Point: 10 °C; 50 °F
• Density: 0.863 g/mL at 20 °C(lit.)
• Refractive Index: n20/D 1.418

Safety Information

• European Hazard Symbols: Flammable (F)
• UN Number: 1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11
• GHS Pictograms: GHS02
• GHS Signal Word: Danger
• GHS Hazard statements: H225
• GHS Precautionary statements: P210
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 2
• Storage Temperature: 2-8°C

Product Information

• Grade: technical
• Linear Formula: CH3OCH[N(CH3)2]2

DETAILS

Sigma Aldrich - 64875

Other Notes
Review1
Packaging
10, 50 mL in glass bottle