acetyl fluoride

• ChemBase ID: 125603
• Molecular Formular: C2H3FO
• Molecular Mass: 62.0430232
• Monoisotopic Mass: 62.01679294
• SMILES: FC(=O)C
• Canonical SMILES: CC(=O)F
• InChI: InChI=1S/C2H3FO/c1-2(3)4/h1H3
• InChIKey: JUCMRTZQCZRJDC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: acetyl fluoride
• IUPAC Traditional name: acetyl fluoride
• Synonyms: Acetyl fluoride; Acetyl fluoride; 乙酰氟

Database IDs

• CAS Number: 557-99-3
• EC Number: 209-188-0
• MDL Number: MFCD00000365
• PubChem SID: 162219953; 24850568
• PubChem CID: 11204
• Chemspider ID: 10731
• Wikipedia Title: Acetyl_fluoride

CALCULATED PROPERTIES

• Acid pKa: 18.195951
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.022394683
• LogD (pH = 7.4): 0.022394683
• Log P: 0.022394683
• Molar Refractivity: 11.8672 cm^3
• Polarizability: 4.4026437 Å^3
• Polar Surface Area: 17.07 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -84 °C(lit.); -84°C
• Boiling Point: 20-21 °C(lit.); 21°C
• Density: 1.032 g/cm^3
• Vapor Pressure: 15.61 psi ( 20 °C)

Safety Information

• RTECS: AP2800000
• European Hazard Symbols: Corrosive (C)
• UN Number: 3265
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 1
• Risk Statements: 34
• Safety Statements: 26-36/37/39-45
• GHS Pictograms: GHS corrosion; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US)
• RID/ADR: UN 3265 8/PG 1

Product Information

• Purity: 99%
• Linear Formula: CH3COF

DETAILS

Sigma Aldrich - 176257

Recommended products
Stainless steel hose adapter Z146838 or stainless steel body mini gas regulator Z513547 is recommended.