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CAS No.: | 16346-97-7 |
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Name: | 4,4'-SULFONYLBIS(2-METHYLPHENOL) |
Molecular Structure: | |
Formula: | C14H14O4S |
Molecular Weight: | 278.329 |
Synonyms: | o-Cresol,4,4'-sulfonyldi- (6CI,7CI,8CI);3,3'-Dimethyl-4,4'-dihydroxydiphenyl sulfone;4,4'-Dihydroxy-3,3'-dimethyldiphenyl sulfone;4,4'-Sulfonylbis[2-methylphenol];Bis(3-methyl-4-hydroxyphenyl)sulfone;NSC 85582; |
Density: | 1.343 g/cm3 |
Melting Point: | 273-276 °C(lit.) |
Boiling Point: | 518.8 °C at 760 mmHg |
Flash Point: | 267.6 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 82.98000 |
LogP: | 3.62820 |
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The Phenol,4,4'-sulfonylbis[2-methyl]-, with the CAS registry number 16346-97-7, is also known as Bis(3-methyl-4-hydroxyphenyl)sulfone. This chemical's molecular formula is C14H14O4S and molecular weight is 278.32. What's more, its systematic name is 4,4'-Sulfonylbis(2-methylphenol) and it belongs to the product categories of Bisphenol and Sulfonyldiphenol Monomers; Monomers; Polymer Science. The product should be sealed and stored in cool and dry places. Besides, it should be protected from oxidizers.
Physical properties of Phenol,4,4'-sulfonylbis[2-methyl]- are: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 60.98 Å2; (7)Index of Refraction: 1.617; (8)Molar Refractivity: 72.58 cm3; (9)Molar Volume: 207.2 cm3; (10)Polarizability: 28.77×10-24 cm3; (11)Surface Tension: 54.9 dyne/cm; (12)Density: 1.343 g/cm3; (13)Flash Point: 267.6 °C; (14)Enthalpy of Vaporization: 82.13 kJ/mol; (15)Boiling Point: 518.8 °C at 760 mmHg; (16)Vapour Pressure: 2.2E-11 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccc(O)c(c1)C)c2ccc(O)c(c2)C
(2)InChI: InChI=1/C14H14O4S/c1-9-7-11(3-5-13(9)15)19(17,18)12-4-6-14(16)10(2)8-12/h3-8,15-16H,1-2H3
(3)InChIKey: XTEGBRKTHOUETR-UHFFFAOYSA-N