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Trithiocyanuric acid

Trithiocyanuric acid structure

Trithiocyanuric acid 

structure
  • CAS No:

    638-16-4

  • Formula:

    C3H3N3S3

  • Chemical Name:

    Trithiocyanuric acid

  • Synonyms:

    1,3,5-Triazine-2,4,6(1H,3H,5H)-trithione;s-Triazine-2,4,6-trithiol;s-Triazine-2,4,6(1H,3H,5H)-trithione;Cyanuric acid,trithio-;Trithiocyanuric acid;2,4,6-Trimercapto-s-triazine;Thiocyanuric acid;2,4,6-Triazinetrithiol;1,3,5-Trimercaptotriazine;Trimercaptocyanuric acid;2,4,6-Trimercapto-1,3,5-triazine;s-Triazinetrithiol;1,3,5-Triazine-2,4,6-trithiol;Zisnet F;OF 100;TCY-MBA;Trimercapto-s-triazine;2,4,6-Trithiol-1,3,5-triazine;2,4,6-Trithio-5-azauracil;1,3,5-Triazine-2,4,6-trithione;Trimercaptotriazine;Zisnet FPT;Zeonet A;TCY;Nocceler TCA;2,4,6-Trimercaptotriazine;NSC 62071;NSC 65480;Rhenogran Triazine TM 70ECO;TM 70ECO;Actor TSH;Rhenogran Triazine TM 70AEMD;Taicros TMT;Tatcross TMT;TSH;Curekind TCY;TMT;1,3,5-Triazinane-2,4,6-trithione;Zisnet F-ET;2060-82-4;907189-62-2

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

YELLOW AMORPHOUS POWDER

Trithiocyanuric acid Basic Attributes

177.27

177.27

211-322-8

KX0WZE0QAQ

65480|62071

DTXSID3045067

2933699090

Characteristics

132

0.6

Yellow.

1.3500 g/cm3 @ Temp: 20 °C

>300 °C

419.106°C at 760 mmHg

100.5±22.6 °C

1.903

Slightly soluble in water.

Store in a cool, dry place. Keep container closed when not in use.

Safety Information

2

R36/37/38

S24/25

XZ2830000

Xi

Stable under normal temperatures and pressures.

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 63 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

trithiocyanuric acid

Trithiocyanuric acid Use and Manufacturing

Methods of Manufacturing

100 mg (0.12 mmol) of [RuII(Hmctpy)(dmbpy)(H2O)](PF6)2were dissolved in 15 mL ethanol and 21.3 mg (0.12 mmol) ofH3tmt were added to the stirred solution and refluxed for 4 h inthe dark. After cooling down, the solvent was removed in therotary evaporator and the solid dissolved in the minimum amountof DMF. This solution was added dropwise to a concentrated NH4-PF6 aqueous solution, and the precipitated solid was filtered off andwashed carefully with cold water and ether and dried under vacuum.Further purification was carried out using Sephadex LH-20column chromatography using methanol as eluent. The solid wasloaded and four fractions were eluted from the column; the lastone containing the desired complex. Such fraction was dried underreduced pressure in a rotary evaporator and the hygroscopic solidkept overnight under high vacuum. 1H NMR (500 MHz, methanol d4) delta ppm 2.38 (s, 3H) 2.79 (s, 3H) 6.94 (dd, J = 5.95, 1.07 Hz, 1H) 6.98-7.00 (m, 1H) 7.34 (ddd, J = 7.32, 5.80, 1.22 Hz, 2H) 7.80 (dd, J = 5.80, 1.22 Hz, 1H) 7.86 (dd, J = 5.65, 0.76 Hz, 2H)7.91 (td, J = 7.78, 1.53 Hz, 2H) 8.39 (s, 1H) 8.57 (d, J = 7.93 Hz, 2H)8.63 (s, 1H) 9.04 (s, 2H) 9.79 (d, J = 5.80 Hz, 1H). Calcd(Found) for[Ru(Hmctpy)(dmbpy)(H3 tmt)](PF6)212H2O, C31H50F12N8O14P2-RuS3: C 29.88 (29.43); H 4.05 (3.87); N 8.99 (9.02).

Uses

crosslinking agnt forAR.ECO.CR

1,3,5-Triazine-2,4,6(1H,3H,5H)-trithione: ACTIVE

Computed Properties

Molecular Weight:177.3
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:176.94891063
Monoisotopic Mass:176.94891063
Topological Polar Surface Area:132
Heavy Atom Count:9
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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