Bis(tetrahydrofurfuryl) sebacate
Basic information
- CAS
4650-79-7- Standard SMILES
O=C(CCCCCCCCC(=O)OCC1CCCO1)OCC1CCCO1- InChIKey
RHWOXBBBVFKHAN-UHFFFAOYSA-N- Molecular formula
- C20H34O6
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 370.2355388
Names & identifiers
- Preferred name
- Bis(tetrahydrofurfuryl) sebacate
- IUPAC
- bis(oxolan-2-ylmethyl) decanedioate
- English name
- bis(tetrahydrofurfuryl) sebacate
- Molecular formula
- C20H34O6
- Molecular weight
- 370.48
Names & synonyms
4650-79-7Bis(tetrahydrofurfuryl) sebacateBis((tetrahydrofuran-2-yl)methyl) decanedioatebis(oxolan-2-ylmethyl) decanedioateEINECS 225-080-6NSC24328DitetrahydrofurfurylsebacatSCHEMBL1065271Decanedioic acid, bis[(tetrahydro-2-furanyl)methyl] esterDTXSID40963600NSC 24328NSC-24328
Show more names
Decanedioic acid bis[[(tetrahydrofuran)-2-yl]methyl] esterDecanedioic acid, 1,10-bis[(tetrahydro-2-furanyl)methyl] ester
Bis[(oxolan-2-yl)methyl] decanedioateSebacic acid, di(tetrahydrofurfuryl) esterNS00047352
Database identifiers
- CAS
4650-79-7- PubChem CID
- 95625
- DTXSID
DTXSID40963600- EC Number
- 225-080-6
- Nikkaji
- J297.866K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 15
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 373
Physicochemical properties
- Boiling point
- 445.7 · 445.7±25.0 °C(Predicted)
- Density
- 1.073 · 1.073±0.06 g/cm3(Predicted)
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Compound notes
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