Basic information
- CAS
26429-16-3- Standard SMILES
CCCCC(=O)O[Si](C)(C)C- InChIKey
KBBNGLHDTQGESG-UHFFFAOYSA-N- Molecular formula
- C8H18O2Si
- Average molar mass
- 174.31 g/mol
- Monoisotopic mass
- 174.10760635
Names & identifiers
- Preferred name
- Valeric acid, trimethylsilyl ester
- IUPAC
- trimethylsilyl pentanoate
- English name
- Valeric acid trimethylsilyl ester
- Molecular formula
- C8H18O2Si
- Molecular weight
- 174.31
Names & synonyms
Valeric acid, trimethylsilyl ester26429-16-3DTXSID00334296RefChem:1100916DTXCID10285386Pentanoic acid, trimethylsilyl esterPentanoic acid, TMS derivativeTrimethylsilyl pentanoatepentanoic acid tms esterTrimethylsilyl pentanoate #SCHEMBL4645674SCHEMBL4645675
Show more names
Valeric acid trimethylsilyl ester
SCHEMBL28196127
Database identifiers
- CAS
26429-16-3- PubChem CID
- 520262
- DTXSID
DTXSID00334296- Nikkaji
- J104.900C
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- Boiling point
- 162.6 · 162.6±9.0 °C(Predicted)
- Density
- 0.872 · 0.872±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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