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Name |
7H-Dodecafluoroheptanoyl chloride |
EINECS | N/A |
CAS No. | 41405-35-0 | Density | 1.667 g/cm3 |
PSA | 17.07000 | LogP | 4.19340 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7HClF12O | Boiling Point | 134.6 °C at 760 mmHg |
Molecular Weight | 364.518 | Flash Point | 35.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 34 |
Molecular Structure | Hazard Symbols | C | |
Synonyms |
2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptanoylchloride;7H-Dodecafluoroheptanoyl chloride; |
Article Data | 4 |
The CAS register number of 7H-Dodecafluoroheptanoyl chloride is 41405-35-0. It also can be called as Heptanoyl chloride,2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoro- and the systematic name about this chemical is 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl chloride. The molecular formula about this chemical is C7HClF12O and the molecular weight is 364.52.
Physical properties about 7H-Dodecafluoroheptanoyl chloride are: (1)ACD/LogP: 6.57; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.57; (4)ACD/LogD (pH 7.4): 6.57; (5)ACD/BCF (pH 5.5): 57595.54; (6)ACD/BCF (pH 7.4): 57595.54; (7)ACD/KOC (pH 5.5): 88934.05; (8)ACD/KOC (pH 7.4): 88934.05; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 17.07Å2; (12)Index of Refraction: 1.301; (13)Molar Refractivity: 41.11 cm3; (14)Molar Volume: 218.5 cm3; (15)Polarizability: 16.29x10-24cm3; (16)Surface Tension: 16.5 dyne/cm; (17)Enthalpy of Vaporization: 37.21 kJ/mol; (18)Boiling Point: 134.6 °C at 760 mmHg; (19)Vapour Pressure: 8.03 mmHg at 25°C.
Uses of 7H-Dodecafluoroheptanoyl chloride: it can be used to produce bis-(7H-dodecafluoro-heptanoyl) peroxide at temperature of 0 °C. This reaction will need reagent aq. NaOH 30percent aq. H2O2 and solvent 1,1,2-trichloro-1,2,2-trifluoro-ethane. The yield is about 65%.
When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. 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(Cl)=O)C(F)(F)C(F)(F)C(F)(F)C(F)F
(2)InChI: InChI=1/C7HClF12O/c8-1(21)3(11,12)5(15,16)7(19,20)6(17,18)4(13,14)2(9)10/h2H
(3)InChIKey: SQQWEKUYKNKPOG-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C7HClF12O/c8-1(21)3(11,12)5(15,16)7(19,20)6(17,18)4(13,14)2(9)10/h2H
(5)Std. InChIKey: SQQWEKUYKNKPOG-UHFFFAOYSA-N