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375-97-3

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Basic Information
CAS No.: 375-97-3
Name: 1H-Perfluorodecane
Article Data: 9
Molecular Structure:
Molecular Structure of 375-97-3 (1H-Perfluorodecane)
Formula: C10HF21
Molecular Weight: 520.084
Synonyms: 1-Hydroperfluorodecane;1H-Perfluorodecane;
EINECS: 206-802-9
Density: 1.684g/cm3
Melting Point: 31 °C
Boiling Point: 166.3 °C at 760 mmHg
Flash Point: 60.7 °C
Hazard Symbols: IrritantXi
PSA: 0.00000
LogP: 6.89620
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Specification

The 1H-Perfluorodecane with the CAS number 375-97-3 is also called 1-Hydroperfluorodecane. The systematic name is 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluorodecane. Its EINECS registry number is 206-802-9. The molecular formula is C10HF21. This chemical is irritant. While using this chemical, you should be very cautious.

The properties of the chemical are: (1)ACD/LogP: 8.17; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 8.17; (4)ACD/LogD (pH 7.4): 8.17; (5)ACD/BCF (pH 5.5): 960244.5; (6)ACD/BCF (pH 7.4): 960244.5; (7)ACD/KOC (pH 5.5): 666434.75; (8)ACD/KOC (pH 7.4): 666434.75; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.264; (14)Molar Refractivity: 51.46 cm3; (15)Molar Volume: 308.8 cm3; (16)Polarizability: 20.4×10-24cm3; (17)Surface Tension: 12.6 dyne/cm; (18)Enthalpy of Vaporization: 38.62 kJ/mol; (19)Vapour Pressure: 2.37 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
(2)InChI: InChI=1/C10HF21/c11-1(12)2(13,14)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)31/h1H
(3)InChIKey: DSNMEFYRPYNWJJ-UHFFFAOYAJ

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 20gm/kg (20000mg/kg)   Microvascular Research. Vol. 8, Pg. 320, 1974.