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CAS No.: | 1002-62-6 |
---|---|
Name: | CAPRIC ACID SODIUM SALT |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C10H19NaO2 |
Molecular Weight: | 194.249 |
Synonyms: | Decanoicacid, sodium salt (8CI,9CI);Sodium caprate;Sodiumcaprinate;Sodium decanoate;Sodium decanoic acid; |
EINECS: | 213-688-4 |
Melting Point: | ~240 °C (dec.) |
Boiling Point: | 269.6 °C at 760 mmHg |
Flash Point: | 121.8 °C |
Solubility: | very faint turbidity |
Appearance: | White crystalline |
Safety: | 22-24/25 |
PSA: | 40.13000 |
LogP: | 1.87700 |
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Reported in EPA TSCA Inventory.
The Sodium decanoate is an organic compound with the formula C10H19NaO2. The IUPAC name of this chemical is sodium decanoate. With the CAS registry number 1002-62-6, it is also named as Capric acid sodium salt. The product's classification code is Mutation data. Besides, it should be stored at temperature of 2 - 8 °C. It is the most common fatty acids accelerator.
Physical properties about Sodium decanoate are: (1)ACD/LogP: 3.97; (2)ACD/LogD (pH 5.5): 3.18; (3)ACD/LogD (pH 7.4): 1.38; (4)ACD/BCF (pH 5.5): 98.61; (5)ACD/BCF (pH 7.4): 1.58; (6)ACD/KOC (pH 5.5): 555.11; (7)ACD/KOC (pH 7.4): 8.92; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 37.3 Å2; (12)Flash Point: 121.8 °C; (13)Enthalpy of Vaporization: 53.63 kJ/mol; (14)Boiling Point: 269.6 °C at 760 mmHg; (15)Vapour Pressure: 0.00355 mmHg at 25°C.
Uses of Sodium decanoate: it can be used to produce decanal at ambient temperature. It will need reagent 9-borabicyclo<3.3.1>nonane and solvent tetrahydrofuran with reaction time of 1 hour. The yield is about 88%.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[O-]C(=O)CCCCCCCCC
(2)InChI: InChI=1/C10H20O2.Na/c1-2-3-4-5-6-7-8-9-10(11)12;/h2-9H2,1H3,(H,11,12);/q;+1/p-1
(3)InChIKey: FIWQZURFGYXCEO-REWHXWOFAA
(4)Std. InChI: InChI=1S/C10H20O2.Na/c1-2-3-4-5-6-7-8-9-10(11)12;/h2-9H2,1H3,(H,11,12);/q;+1/p-1
(5)Std. InChIKey: FIWQZURFGYXCEO-UHFFFAOYSA-M