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Tetrapropylammonium tetrafluoroborate

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Name

Tetrapropylammonium tetrafluoroborate

EINECS 206-416-0
CAS No. 338-38-5 Density 1.115 g/cm3
PSA 0.00000 LogP 4.74320
Solubility N/A Melting Point 245-247 °C
Formula C12H28BF4N Boiling Point N/A
Molecular Weight 273.166 Flash Point N/A
Transport Information N/A Appearance white crystal
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 338-38-5 (TETRAPROPYLAMMONIUM TETRAFLUOROBORATE) Hazard Symbols IrritantXi;CorrosiveC
Synonyms

n,n,n-Tripropylpropan-1-aminium tetrafluoroborate;

Article Data 2

Tetrapropylammonium tetrafluoroborate Specification

The Tetrapropyl ammonium tetrafluoroborate, with the CAS registry number of 338-38-5, is also known as n,n,n-Tripropylpropan-1-aminium tetrafluoroborate. Its EINECS number is 206-416-0. Its molecular formula is C12H28BF4N and molecular weight is 273.16. What's more, its IUPAC name is Tetrapropylazanium tetrafluoroborate.

Physical properties about the Tetrapropyl ammonium tetrafluoroborate are: (1)ACD/LogP: -2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.64; (4)ACD/LogD (pH 7.4): -2.64; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 0 Å2.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1) SMILES: F[B-](F)(F)F.[N+](CCC)(CCC)(CCC)CCC
(2) InChI: InChI=1/C12H28N.BF4/c1-5-9-13(10-6-2,11-7-3)12-8-4;2-1(3,4)5/h5-12H2,1-4H3;/q+1;-1
(3) InChIKey: ADADJCUTHQJPCB-UHFFFAOYAH

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5600ug/kg (5.6mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02197,

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