Sodium butyrateProduct ingredient for Butyric Acid
- Name
- Sodium butyrate
- Drug Entry
- Butyric Acid
A four carbon acid, CH3CH2CH2COOH, with an unpleasant odor that occurs in butter and animal fat as the glycerol ester.
- Accession Number
- DBSALT002877
- Structure
- Synonyms
- Not Available
- UNII
- 8RAS91C36W
- CAS Number
- 156-54-7
- Weight
- Average: 110.088
Monoisotopic: 110.03437375 - Chemical Formula
- C4H7NaO2
- InChI Key
- MFBOGIVSZKQAPD-UHFFFAOYSA-M
- InChI
- InChI=1S/C4H8O2.Na/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1
- IUPAC Name
- sodium butanoate
- SMILES
- [Na+].CCCC([O-])=O
- External Links
- ChemSpider
- 8727
- ChEBI
- 64103
- ChEMBL
- CHEMBL62381
- Wikipedia
- Sodium_butyrate
- Predicted Properties
Property Value Source Water Solubility 168.0 mg/mL ALOGPS logP 1.16 ALOGPS logP 0.92 Chemaxon logS 0.18 ALOGPS pKa (Strongest Acidic) 4.91 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 40.13 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 32.71 m3·mol-1 Chemaxon Polarizability 8.8 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon