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Name |
Hexasulfide,bis(1,1-dimethylethyl)- |
EINECS | 230-825-3 |
CAS No. | 7330-33-8 | Density | 1.254 g/cm3 |
PSA | 151.80000 | LogP | 6.55760 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H18S6 | Boiling Point | 395.4 °C at 760 mmHg |
Molecular Weight | 306.6185 | Flash Point | 191.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Hexasulfide,bis(1,1-dimethylethyl) (9CI);tert-Butyl hexasulfide (7CI,8CI);Di-tert-butyl perhexasulfide; |
The Hexasulfide,bis(1,1-dimethylethyl)-, with the CAS registry number 7330-33-8, is also known as Di-tert-butyl perhexasulfide. Its EINECS registry number is 230-825-3. This chemical's molecular formula is C8H18S6 and molecular weight is 306.6185. What's more, its systematic name is Di-tert-butylhexasulfane.
Physical properties about Hexasulfide,bis(1,1-dimethylethyl)- are: (1)ACD/LogP: 8.48; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.48; (4)ACD/LogD (pH 7.4): 8.48; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 979451.69; (8)ACD/KOC (pH 7.4): 979451.69; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 151.8 Å2; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 87.02 cm3; (15)Molar Volume: 244.5 cm3; (16)Polarizability: 34.49×10-24 cm3; (17)Surface Tension: 48.2 dyne/cm; (18)Density: 1.254 g/cm3; (19)Flash Point: 191.2 °C; (20)Enthalpy of Vaporization: 62.04 kJ/mol; (21)Boiling Point: 395.4 °C at 760 mmHg; (22)Vapour Pressure: 4.2E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: S(SSSSSC(C)(C)C)C(C)(C)C
(2)InChI: InChI=1/C8H18S6/c1-7(2,3)9-11-13-14-12-10-8(4,5)6/h1-6H3
(3)InChIKey: ISVXFCLKAVEYPW-UHFFFAOYAJ