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CAS No.: | 107484-84-4 |
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Name: | 3-ISOPROPYL-5-PHENYL-3,4,5,6-TETRAHYDRO-2H-1,3,5-THIADIAZOLIDINE-2,4-DIONE |
Molecular Structure: | |
Formula: | C12H14N2O2S |
Molecular Weight: | 250.32 |
Synonyms: | 3-Isopropyl-5-phenyl-1,3,5-thiadiazinane-2,4-dione;3-ISOPROPYL-5-PHENYL-3,4,5,6-TETRAHYDRO-2H-1,3,5-THIADIAZOLIDINE-2,4-DIONE; |
Density: | 1.268 g/cm3 |
Boiling Point: | 354.3 °C at 760 mmHg |
Flash Point: | 168.1 °C |
PSA: | 65.92000 |
LogP: | 3.15060 |
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The 3-Isopropyl-5-phenyl-1,3,5-thiadiazinane-2,4-dione with the cas number 107484-84-4 is also called 2H-1,3,5-Thiadiazine-2,4(3H)-dione,dihydro-3-(1-methylethyl)-5-phenyl-. Its molecular formula is C12H14N2O2S. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.4; (4)ACD/LogD (pH 7.4): 1.4 ; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 65.92 Å2; (9)Index of Refraction: 1.602; (10)Molar Refractivity: 67.69 cm3; (11)Molar Volume: 197.3 cm3; (12)Polarizability: 26.83×10-24cm3; (13)Surface Tension: 51.1 dyne/cm; (14)Enthalpy of Vaporization: 59.93 kJ/mol; (15)Vapour Pressure: 3.39×10-5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)N1C(=O)N(CSC1=O)c2ccccc2
(2)InChI: InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
(3)InChIKey: GOJMUZCNDMODEZ-UHFFFAOYAT