2-Pentanone, 1-(2-furyl)-
Basic information
- CAS
20907-03-3- Standard SMILES
CCCC(=O)Cc1ccco1- InChIKey
NIVNFVHGZUNULS-UHFFFAOYSA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- 2-Pentanone, 1-(2-furyl)-
- IUPAC
- 1-(furan-2-yl)pentan-2-one
- English name
- 1-(2-Furyl)-2-pentanone
- Molecular formula
- C9H12O2
- Molecular weight
- 152.19
Names & synonyms
20907-03-32-Pentanone, 1-(2-furyl)-2-Pentanone, 1-(2-furanyl)-DTXSID00337000RefChem:264984DTXCID00288088NIVNFVHGZUNULS-UHFFFAOYSA-N1-(furan-2-yl)pentan-2-one1-(2-Furyl)-2-pentanoneMFCD007786011-(2-furyl)pentan-2-one1-(2-Furyl)-2-pentanone #
Show more names
1-(2-Furanyl)-2-pentanone1-(2-furyl)-2-pentanone(SALTDATA: FREE)
SCHEMBL29211196AKOS006275594BS-35843DB-179874CS-0336486F310759
Database identifiers
- CAS
20907-03-3- PubChem CID
- 537797
- DTXSID
DTXSID00337000- Nikkaji
- J113.990H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Boiling point
- 60 · 60-61 °C(Press: 1 Torr)
- Density
- 1.0899 g/cm3 · 1.0899 g/cm3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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