Acetic acid,2,2'-[carbonothioylbis(thio)]bis- supplier

Name
BIS(CARBOXYMETHYL) TRITHIOCARBONATE
EINECS 228-693-7
CAS No. 6326-83-6
Article Data14
CAS DataBase
Density 1.698 g/cm³
Solubility
Melting Point 172-175 °C(lit.)
Formula C₅H₆O₄S₃
Boiling Point 532.5 °C at 760 mmHg
Molecular Weight 226.298
Flash Point 275.9 °C
Transport Information
Appearance yellow fine powder
Safety 24/25
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms Carbonicacid, trithio-, bis(carboxymethyl) ester (6CI);Carbonic acid, trithio-,diester with mercaptoacetic acid (8CI);Bis(carboxymethyl) trithiocarbonate;Di(carboxymethyl) trithiocarbonate;NSC 30797;Thiocarbonyldithioglycolic acid;Trithiocarbodiglycolic acid;
PSA 157.29000
LogP 0.90690

Acetic acid,2,2'-[carbonothioylbis(thio)]bis- Specification

The Acetic acid,2,2'-[carbonothioylbis(thio)]bis-, with the CAS registry number 6326-83-6, is also known as Bis(carboxymethyl) trithiocarbonate. It belongs to the product categories of Carboxylic Acid Monomers; Monomers; Polymer Science. Its EINECS registry number is 228-693-7. This chemical's molecular formula is C₅H₆O₄S₃ and molecular weight is 226.29. Its IUPAC name is called 2-(carboxymethylsulfanylcarbothioylsulfanyl)acetic acid. This chemical is yellow fine powder. When you are using this chemical, please be cautious about it. This chemical is irritating to eyes, respiratory system and skin. You should avoid contacting it with skin and eyes.

Physical properties of Acetic acid,2,2'-[carbonothioylbis(thio)]bis-: (1)ACD/LogP: 1.39; (2)ACD/LogD (pH 5.5): -3.23; (3)ACD/LogD (pH 7.4): -3.36; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Index of Refraction: 1.702; (12)Molar Refractivity: 51.62 cm³; (13)Molar Volume: 133.2 cm³; (14)Surface Tension: 101.1 dyne/cm; (15)Density: 1.698 g/cm³; (16)Flash Point: 275.9 °C; (17)Enthalpy of Vaporization: 88.42 kJ/mol; (18)Boiling Point: 532.5 °C at 760 mmHg; (19)Vapour Pressure: 9.26E-13 mmHg at 25°C.

Uses of Acetic acid,2,2'-[carbonothioylbis(thio)]bis-: it can be used to produce [1,2,4,5]tetrazinane-3,6-dithione. This reaction will need reagent aq. NaOH solution.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(C(=O)O)SC(=S)SCC(=O)O
(2)InChI: InChI=1S/C5H6O4S3/c6-3(7)1-11-5(10)12-2-4(8)9/h1-2H2,(H,6,7)(H,8,9)
(3)InChIKey: GQECANUIPBFPLA-UHFFFAOYSA-N

Product Name

BIS(CARBOXYMETHYL) TRITHIOCARBONATE

Acetic acid,2,2'-[carbonothioylbis(thio)]bis- Specification

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