Completing data — usually done within a minute
Basic information
- Standard SMILES
CCOC(OCC)c1ccco1- InChIKey
SEILDMUKBMYIEZ-UHFFFAOYSA-N- Molecular formula
- C9H14O3
- Average molar mass
- 170.208 g/mol
- Monoisotopic mass
- 170.09429431
Names & identifiers
- Preferred name
- Furan, 2-(diethoxymethyl)-
- IUPAC
- 2-(Diethoxymethyl)furan
- English name
- 2-Furaldehyde diethyl acetal
- Molecular formula
- C9H14O3
- Molecular weight
- 170.21
Names & synonyms
2-(Diethoxymethyl)furanSKL11702-(diethoxymethyl)-furafurfural diethyl acetal2-(diethoxymethyl)furaneFuran, 2-(diethoxymethyl)-2-FURALDEHYDE DIETHYL ACETAL2-FuraldehydeDiethylAcetal>2-FURALDEHYDE DIETHYL ACETAL 98%2-Furaldehyde diethyl acetal,98%
Database identifiers
- CAS
13529-27-6- PubChem CID
- 83553
- DTXSID
DTXSID10864418- ChEBI
CHEBI:34769- UNII
- 04B3GME3IJ
- EC Number
- 236-872-6
- Nikkaji
- J241.168G
Properties
Physicochemical properties
- Boiling point
- 189 · 189-191 °C (lit.)
- Density
- 1.008 g/mL · 1.008 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.444(lit.)
- Flash point
- 148 °F · 148 °F
- storage temp.
- 0 · 0-6°C
- form
- clear liquid
- Specific Gravity
- 1.008 · 1.008
- color
- White to Yellow to Green
- Odor
- 100 % · at 100.00 %. fruity earthy mushroom
- Odor Type
- fruity
- InChI
- 1S/C9H14O3/c1-3-10-9(11-4-2)8-6-5-7-12-8/h5-7,9H,3-4H2,1-2H3
- InChIKey
- SEILDMUKBMYIEZ-UHFFFAOYSA-N
- SMILES
- CCOC(OCC)c1ccco1
- LogP
- 2.272 · 2.272 (est)
- CAS DataBase Reference
- 13529 · 13529-27-6(CAS DataBase Reference)
- FDA UNII
- 4 B3GME3IJ · 04B3GME3IJ
- NIST Chemistry Reference
- 2 · 2-Furaldehyde diethyl acetal(13529-27-6)
- EPA Substance Registry System
- 2 · Furan, 2-(diethoxymethyl)- (13529-27-6)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36-24/25
- WGK Germany
- 3 · 3
- RTECS
- 585000 · LU0585000
- TSCA
- TSCA listed
- HS Code
- 29321900 · 29321900
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
- REACH Registrations
- Active
Safety & regulation
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- LU0585000
- hs_code
- 29321900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-24/25
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- REACH Registrations
- Active
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses2-Furaldehyde diethyl acetal was used in the synthesis of:5-pyridyl- and 5-aryl-2-furaldehydes via Palladium-mediated cross-coupling reaction11-oxatricyclo [5.3. 1.02, 6] undecane derivatives
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
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Additional notes
DefinitionChEBI: Furfural diethyl acetal is a member of furans.
Related reactions
3 records
Linked notes
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