2-(furan-2-ylmethylidene)-1,1-dimethylhydrazine

• ChemBase ID: 151236
• Molecular Formular: C7H10N2O
• Molecular Mass: 138.1671
• Monoisotopic Mass: 138.07931295
• SMILES: CN(C)/N=C/c1ccco1
• Canonical SMILES: CN(/N=C/c1ccco1)C
• InChI: InChI=1S/C7H10N2O/c1-9(2)8-6-7-4-3-5-10-7/h3-6H,1-2H3
• InChIKey: DURWBNUASAZMSN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(furan-2-ylmethylidene)-1,1-dimethylhydrazine
• IUPAC Traditional name: 2-(furan-2-ylmethylidene)-1,1-dimethylhydrazine
• Synonyms: Furfural dimethylhydrazone; 2-Furaldehyde dimethylhydrazone; 2-Furaldehyde 2,2-dimethylhydrazone; Furfural 2,2-dimethyl hydrazone; 2-糠醛 2,2-二甲基腙; 2-糠醛二甲基腙; 2-糠醛 2,2-二甲基腙

Database IDs

• CAS Number: 14064-21-2
• MDL Number: MFCD00010685
• PubChem SID: 24857485; 162245392
• PubChem CID: 5324609

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.6278885
• LogD (pH = 7.4): 0.62795
• Log P: 0.6279508
• Molar Refractivity: 40.1834 cm^3
• Polarizability: 14.864464 Å^3
• Polar Surface Area: 28.74 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 69°C/2mm; 98 °C/9.5 mmHg(lit.)
• Flash Point: 195.8 °F; 91 °C; 92°C(198°F)
• Density: 1.042 g/mL at 25 °C(lit.); 1.048
• Refractive Index: 1.5800; n20/D 1.578(lit.)

Safety Information

• European Hazard Symbols: X; Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 22-36/38; 36/37/38
• Safety Statements: 26-36/37; 26-36/37/39
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H315-H319-H227; H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P280H-P305+P351+P338
• 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: 97%; 98%
• Empirical Formula (Hill Notation): C7H10N2O

DETAILS

Sigma Aldrich - 290769

Packaging
50 g in glass bottle