Sodium propionateProduct ingredient for Propanoic acid

Name
Sodium propionate
Drug Entry
Propanoic acid

Sodium propionate is the sodium salt of propionic acid that exists as colorless, transparent crystals or a granular crystalline powder. It is considered generally recognized as safe (GRAS) food ingredient by FDA, where it acts as an antimicrobial agent for food preservation and flavoring agent. Its use as a food additive is also approved in Europe. Sodium propionate is is prepared by neutralizing propionic acid with sodium hydroxide. Sodium propionate was previously approved in Canada as an active ingredient in Amino-Cerv (used to treat inflammation or injury of the cervix).

Accession Number
DBSALT002690  (DB13440)
Structure
Thumb
Synonyms
Sodium propionate hydrate
UNII
DK6Y9P42IN
CAS Number
6700-17-0
Weight
Average: 114.076
Monoisotopic: 114.02928837
Chemical Formula
C3H7NaO3
InChI Key
HOAUAOBUGFYWMK-UHFFFAOYSA-M
InChI
InChI=1S/C3H6O2.Na.H2O/c1-2-3(4)5;;/h2H2,1H3,(H,4,5);;1H2/q;+1;/p-1
IUPAC Name
sodium hydrate propanoate
SMILES
O.[Na+].CCC([O-])=O
PubChem Compound
23663426
PubChem Substance
347829300
ChemSpider
178477
ChEMBL
CHEMBL3989705
Wikipedia
Sodium_propionate
Predicted Properties
PropertyValueSource
Water Solubility286.0 mg/mLALOGPS
logP0.49ALOGPS
logP0.48ChemAxon
logS0.47ALOGPS
pKa (Strongest Acidic)4.75ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area40.13 Å2ChemAxon
Rotatable Bond Count1ChemAxon
Refractivity28.11 m3·mol-1ChemAxon
Polarizability6.84 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon