1,2,3-Triethoxypropane
Basic information
- CAS
162614-45-1- Standard SMILES
CCOCC(COCC)OCC- InChIKey
PFADYQLMUXOXGM-UHFFFAOYSA-N- Molecular formula
- C9H20O3
- Average molar mass
- 176.25 g/mol
- Monoisotopic mass
- 176.1412445
Names & identifiers
- Preferred name
- 1,2,3-Triethoxypropane
- IUPAC
- 1,2,3-triethoxypropane
- English name
- Triethylin
- Molecular formula
- C9H20O3
- Molecular weight
- 176.25
Names & synonyms
1,2,3-Triethoxypropane162614-45-1DTXSID601314250RefChem:1052013DTXCID901744060TRIETHYLINGlycerol triethyl ethertriethylineglycerine triethyl ether1,2,3-Triethoxypropane #SCHEMBL208312SCHEMBL6437279
Show more names
Propane, 1,2,3-triethoxy-
PFADYQLMUXOXGM-UHFFFAOYSA-InChI=1/C9H20O3/c1-4-10-7-9(12-6-3)8-11-5-2/h9H,4-8H2,1-3H3
Database identifiers
- CAS
162614-45-1- PubChem CID
- 548321
- DTXSID
DTXSID601314250- EC Number
- 605-295-5
- Nikkaji
- J149.460K
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 77.8
Physicochemical properties
- Boiling point
- 78 · 78-80 °C(Press: 15 Torr)
- Density
- 0.889 g/cm3 · 0.889 g/cm3(Temp: 25 °C)
Related reactions
1 records
Compound notes
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