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Name	Carbonotrithioic acid,diphenyl ester	EINECS	N/A
CAS No.	2314-54-7	Density	1.31 g/cm³
PSA	82.69000	LogP	4.85590
Solubility	N/A	Melting Point	N/A
Formula	C₁₃H₁₀S₃	Boiling Point	430.1 °C at 760 mmHg
Molecular Weight	262.42	Flash Point	213.9 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Phenyl trithiocarbonate;Trithiocarbonic acid diphenyl ester;NSC157932;Diphenyl trithiocarbonate;Carbonicacid, trithio-, diphenyl ester (6CI,7CI,8CI);	Article Data	11

Carbonotrithioic acid,diphenyl ester Specification

The Carbonotrithioic acid,diphenyl ester, with the CAS registry number 2314-54-7, is also known as Phenyl trithiocarbonate. This chemical's molecular formula is C₁₃H₁₀S₃ and molecular weight is 262.4135. Its IUPAC name is called bis(phenylsulfanyl)methanethione.

Physical properties of Carbonotrithioic acid,diphenyl ester: (1)ACD/LogP: 5.62; (2)# of Rule of 5 Violations: 1; (3)#Freely Rotating Bonds: 4; (4)Index of Refraction: 1.721; (5)Molar Refractivity: 79.23 cm³; (6)Molar Volume: 200.2 cm³; (7)Surface Tension: 65.2 dyne/cm; (8)Density: 1.31 g/cm³; (9)Flash Point: 213.9 °C; (10)Enthalpy of Vaporization: 65.9 kJ/mol; (11)Boiling Point: 430.1 °C at 760 mmHg; (12)Vapour Pressure: 3.35E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)SC(=S)SC2=CC=CC=C2
(2)InChI: InChI=1S/C13H10S3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H
(3)InChIKey: UHXNHMBEGXLRMF-UHFFFAOYSA-N

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