CAS No.3107-98-0,DIMETHYL OCTAFLUOROADIPATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	3107-98-0
Name:	DIMETHYL OCTAFLUOROADIPATE
Article Data:	8

Formula:	C₈H₆F₈O₄
Molecular Weight:	318.12
Synonyms:	Hexanedioicacid, octafluoro-, dimethyl ester (7CI,8CI,9CI);Dimethyl octafluoroadipate;Dimethyl perfluoroadipate;Dimethyl perfluorohexanedioate;
EINECS:	-0
Density:	1.505 g/cm³
Boiling Point:	196.1 °C at 760 mmHg
Flash Point:	70.7 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	52.60000
LogP:	1.87360

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Specification

The CAS register number of Hexanedioic acid,2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester is 3107-98-0. It also can be called as 2-(Trifluoromethyl)phenylhydrazinehydrochloride and the systematic name about this chemical is dimethyl octafluorohexanedioate. The molecular formula about this chemical is C₈H₆F₈O₄ and the molecular weight is 318.12.

Physical properties about Hexanedioic acid,2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester are: (1)ACD/LogP: 4.86; (2)ACD/LogD (pH 5.5): 4.86; (3)ACD/LogD (pH 7.4): 4.86; (4)ACD/BCF (pH 5.5): 2913.46; (5)ACD/BCF (pH 7.4): 2913.46; (6)ACD/KOC (pH 5.5): 10505.57; (7)ACD/KOC (pH 7.4): 10505.57; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 7; (10)Polar Surface Area: 52.6Å²; (11)Index of Refraction: 1.336; (12)Molar Refractivity: 43.83 cm³; (13)Molar Volume: 211.3 cm³; (14)Polarizability: 17.37x10^-24cm³; (15)Surface Tension: 21.7 dyne/cm; (16)Enthalpy of Vaporization: 43.23 kJ/mol; (17)Boiling Point: 196.1 °C at 760 mmHg; (18)Vapour Pressure: 0.405 mmHg at 25°C.

Uses of Hexanedioic acid,2,2,3,3,4,4,5,5-octafluoro-, 1,6-dimethyl ester: it can be used to produce 2,2,3,3,4,4,5,5-octafluoro-6-hydroxy-6,6-diphenyl-hexanoic acid methyl ester with phenylmagnesium bromide at temperature of 36 - 38 ℃. This reaction will need solvent diethyl ether with reaction time of 2 hours. The yield is about 34%.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(C(F)(F)C(=O)OC)C(F)(F)C(F)(F)C(=O)OC
(2)InChI: InChI=1/C8H6F8O4/c1-19-3(17)5(9,10)7(13,14)8(15,16)6(11,12)4(18)20-2/h1-2H3
(3)InChIKey: XPXVIIILXUOEQA-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C8H6F8O4/c1-19-3(17)5(9,10)7(13,14)8(15,16)6(11,12)4(18)20-2/h1-2H3
(5)Std. InChIKey: XPXVIIILXUOEQA-UHFFFAOYSA-N