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Basic information
- Standard SMILES
CCCC(=O)OC[C@H](O)CO- InChIKey
RIEABXYBQSLTFR-ZCFIWIBFSA-N- Molecular formula
- C7H14O4
- Average molar mass
- 162.18 g/mol
Names & identifiers
- Preferred name
- (-)-D-Glycerol 1-butyrate
- English name
- (-)-D-Glycerol 1-butyrate
- Molecular formula
- C7H14O4
- Molecular weight
- 162.18
Names & synonyms
(-)-D-Glycerol 1-butyrate(-)-D-Glycerol 1-butyrate(-)-1-O-Butyryl-D-glycerol[R,(-)]-1,2,3-Propanetriol 1-butyrateButanoic acid, (2R)-2,3-dihydroxypropyl ester(-)-Butyric acid (R)-2,3-dihydroxypropyl ester
Database identifiers
- CAS
5309-42-2- PubChem CID
- 6999803
- UNII
- 9FO066O69R
- Nikkaji
- J71.750I
Properties
Physicochemical properties
- alpha
- 18 · D18 -0.63°; D25 -7.40° (c = 2.04 in pyridine)
- Boiling point
- 280.462 · 280.462±20.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.135 · 1.135±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- refractive index
- 20 · nD20 1.4493
- pka
- 13.159 · 13.159±0.20(predicted)
- FDA UNII
- 9 FO066O69R · 9FO066O69R
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
佛山合硕医药科技有限公司15363639686 · [email protected]
Related reactions
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