Basic information
- CAS
107821-61-4- Standard SMILES
CCCCOC(=O)c1cocc1C(=O)OCCCC- InChIKey
MBEAJCADYVDFCS-UHFFFAOYSA-N- Molecular formula
- C14H20O5
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.13107373
Names & identifiers
- Preferred name
- Dibutyl 3,4-furandicarboxylate
- IUPAC
- dibutyl furan-3,4-dicarboxylate
- English name
- 3,4-dibutyl furan-3,4-dicarboxylate
- Molecular formula
- C14H20O5
- Molecular weight
- 268.3056
Names & synonyms
dibutyl 3,4-furandicarboxylate107821-61-4RefChem:586511654-338-4dibutyl furan-3,4-dicarboxylateNSC166356SCHEMBL2277896AKOS024323199NSC-1663563,4-dibutyl furan-3,4-dicarboxylate
Database identifiers
- CAS
107821-61-4- PubChem CID
- 296308
- EC Number
- 654-338-4
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 262
Physicochemical properties
- Hazard statements
- 413 · H413
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- Hazard statements
- H413
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…