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CAS No.: | 203389-28-0 |
---|---|
Name: | 1-Butylpyridinium tetrafluoroborate |
Molecular Structure: | |
Formula: | C9H14BF4N |
Molecular Weight: | 223.02 |
Synonyms: | N-Butylpyridinium tetrafluoroborate; |
EINECS: | 679-531-0 |
Density: | 1.22 |
Melting Point: | 6.64 °C(Solv: acetonitrile (75-05-8)) |
Appearance: | clear pale yellow viscous oil |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 37/39-26 |
PSA: | 3.88000 |
LogP: | 3.07420 |
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The 1-Butylpyridinium tetrafluoroborate, with the CAS registry number 203389-28-0, is also known as N-Butylpyridinium tetrafluoroborate. It belongs to the product category of Ionic Liquid. This chemical's molecular formula is C9H14BF4N and molecular weight is 223.02. What's more, its systematic name is 1-Butylpyridinium tetrafluoroborate. In addition, it must be stored in airtight containers and placed in a dry, cool place.
Physical properties about 1-Butylpyridinium tetrafluoroborate are: (1)ACD/LogP: -3.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.3; (4)ACD/LogD (pH 7.4): -3.3; (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: 3; (12)Polar Surface Area: 3.88 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. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable 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: F[B-](F)(F)F.[n+]1(ccccc1)CCCC
(2) InChI: InChI=1/C9H14N.BF4/c1-2-3-7-10-8-5-4-6-9-10;2-1(3,4)5/h4-6,8-9H,2-3,7H2,1H3;/q+1;-1
(3) InChIKey: XLWDQAHXRCBPEE-UHFFFAOYAJ