Name
|
|
EINECS
|
214-757-1
|
CAS No.
|
1192-62-7
|
Density
|
1.098 g/mL at 25 °C
|
PSA
|
30.21000
|
LogP
|
1.48220
|
Solubility
|
slightly soluble
|
Melting Point
|
26-28 °C
|
Formula
|
C6H6O2
|
Boiling Point
|
183.4 °C at 760 mmHg
|
Molecular Weight
|
110.112
|
Flash Point
|
160 °F
|
Transport Information
|
UN 2811 6.1/PG 2
|
Appearance
|
Colorless to light yellow liquid
|
Safety
|
26-36/37/39-45-39-38-28A
|
Risk Codes
|
20/21-25-41-36/37-23/25
|
Molecular Structure
|
|
Hazard Symbols
|
T
|
Synonyms
|
1-(2-furyl)ethanone;Ketone, 2-furyl methyl;Methyl 2-furyl ketone;ethanone, 1-(2-furanyl)-;2-Furyl methyl ketone;Ethanone, 1- (2-furanyl)-;Acetylfuran;2-Acetyl Furan, Natural;2-Acetylfuran , Natural;
|
Article Data |
127
|
2-Acetylfuran Synthetic route
2-Acetylfuran Chemical Properties
Molecular Structure of 2-Acetylfuran (CAS NO.1192-62-7):
IUPAC Name: 1-(Furan-2-yl)ethanone
Canonical SMILES: CC(=O)C1=CC=CO1
InChI: InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
InChIKey: IEMMBWWQXVXBEU-UHFFFAOYSA-N
Molecular Weight: 110.11064 [g/mol]
Molecular Formula: C6H6O2
XLogP3: 0.5
H-Bond Donor: 0
H-Bond Acceptor: 2
EINECS: 214-757-1
Appearance: Colorless to light yellow liquid
Melting Point: 26-28 °C(lit.)
Boiling Point: 67 °C10 mm Hg(lit.)
Density: 1.098 g/mL at 25 °C(lit.)
FEMA: 3163
Refractive index: n20/D 1.5070(lit.)
Flash Point: 160 °F
storage temp.: 2-8 °C
Classification Code: Mutation data
Product Categories: ACETYLGROUP; Aromatic Ketones (substituted); Furan & Benzofuran; Furans; furnan Flavor
2-Acetylfuran Toxicity Data With Reference
1. | | mma-sat 165 nmol/plate | | DFSCDX Developments in Food Science. 13 (1986),353. |
2. | | dnr-bcs 5500 µg/disc | | DFSCDX Developments in Food Science. 13 (1986),353. |
3. | | cyt-ham:ovr 4500 µmol/L | | CALEDQ Cancer Letters (Shannon, Ireland). 13 (1981),89. |
2-Acetylfuran Consensus Reports
Reported in EPA TSCA Inventory.
2-Acetylfuran Safety Profile
Mutation data reported. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating vapors.
Safety Information of 2-Acetylfuran (CAS NO.1192-62-7):
Hazard Codes: T
Risk Statements:
25: Toxic if swallowed
41: Risk of serious damage to eyes
20/21: Harmful by inhalation and in contact with skin
23/25: Toxic by inhalation and if swallowed
36/37: Irritating to eyes and respiratory system
Safety Statements:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
38: In case of insufficient ventilation, wear suitable respiratory equipment
39: Wear eye/face protection
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
36/37/39: Wear suitable protective clothing, gloves and eye/face protection
RIDADR:UN 2811 6.1/PG 2
WGK Germany:3
RTECS:OB3870000
Hazard Note:Toxic
2-Acetylfuran Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid
2-Acetylfuran Specification
2-Acetylfuran (CAS NO.1192-62-7), its Synonyms are 2-Furyl methyl ketone ; 2-Furyl methyl ketone (natural) ; 2-Furylethanone ; 1-(2-Furanyl)ethanone ; 1-(2-Furyl)ethanone ; Ethanone, 1-(2-furanyl)- ; FEMA No. 3163 ; Furan, 2-acetyl- ; Ketone, 2-furyl methyl ; Methyl 2-furyl ketone ; Acetylfuran .