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Stannous octoate

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Name

Stannous octoate

EINECS 206-108-6
CAS No. 301-10-0 Density 1.251g/mLat 25°C(lit.)
PSA 80.26000 LogP 1.52460
Solubility Miscible with water. Melting Point <-20°C
Formula C16H30O4Sn Boiling Point 228 °C at 760 mmHg
Molecular Weight 405.10 Flash Point 116.6 °C
Transport Information N/A Appearance liquid
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 301-10-0 (Stannous octoate) Hazard Symbols IrritantXi
Synonyms

Hexanoicacid, 2-ethyl-, tin(2+) salt (8CI,9CI);2-Ethylhexanoic acid tin(2+) salt;BTN-Cat 110;D 19;Dabco T 10;DabcoT 16;Desmorapid SO;Fascat 2003;KCS 405T;Kosmos 29;Kosmos K 5N;NSC 75857;Neostann U 28;Niax D 19;Nuocure 28;PC CAT T 9;S93-5037;Stannous 2-ethylcaproate;Stannous2-ethylhexoate;Stannous octoate;Stannous(II) ethylhexanoate;Stanoct;Stanoct T 90;Tegokat 129;Tin bis(2-ethylcaproate);Tin bis(2-ethylhexanoate);Tin octoate;Tin(2+) 2-ethylhexanoate;Tin(II) 2-ethylhexanoate;U 28;XY 70;

 

Stannous octoate Specification

The Hexanoic acid,2-ethyl-, tin(2+) salt (2:1), with the CAS registry number 301-10-0 and EINECS registry number 206-108-6, has the systematic name of tin(2+) bis(2-ethylhexanoate). It belongs to the product category of Organic-metal salt. The molecular formula of the chemical is C16H30O4Sn.

The characteristics of Hexanoic acid,2-ethyl-, tin(2+) salt (2:1) are as followings: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.96; (4)ACD/LogD (pH 7.4): 0.17; (5)ACD/BCF (pH 5.5): 11.85; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 123.98; (8)ACD/KOC (pH 7.4): 2.01; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 37.3 Å2; (13)Flash Point: 116.6 °C; (14)Enthalpy of Vaporization: 51.18 kJ/mol; (15)Boiling Point: 228 °C at 760 mmHg; (16)Vapour Pressure: 0.027 mmHg at 25°C. 

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sn+2]
(2)InChI: InChI=1/2C8H16O2.Sn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
(3)InChIKey: KSBAEPSJVUENNK-NUQVWONBAV

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