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(1-Butyl)triethylammonium bromide

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Name

(1-Butyl)triethylammonium bromide

EINECS N/A
CAS No. 13028-69-8 Density N/A
PSA 0.00000 LogP -0.33300
Solubility Soluble in water. Melting Point 212-215°C
Formula C10H24BrN Boiling Point N/A
Molecular Weight 238.211 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26-36/37/39-36 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 13028-69-8 ((1-Butyl)triethylammonium bromide) Hazard Symbols HarmfulXn
Synonyms

1-Butanaminium,N,N,N-triethyl-, bromide (9CI);Ammonium, butyltriethyl-, bromide (8CI);Butyltriethylammonium bromide (6CI,7CI);Triethylbutylammonium bromide;n-Butyltriethylammonium bromide;

Article Data 16

(1-Butyl)triethylammonium bromide Specification

The (1-Butyl)triethylammonium bromide with cas registry number of 13028-69-8, has the systematic name of N,N,N-triethylbutan-1-aminium bromide. And it is also called 1-butanaminium, N,N,N-triethyl-, bromide (1:1).

Physical properties about this chemical are: (1)ACD/LogP: -2.80; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 0 Å2.

When you are using this chemical, please be cautious about it as the following:
The (1-Butyl)triethylammonium bromide irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
Besides this, this chemical is harmful by inhalation, in contact with skin and if swallowed.

You can still convert the following datas into molecular structure:
(1)SMILES: [Br-].CC[N+](CC)(CC)CCCC
(2)InChI: InChI=1/C10H24N.BrH/c1-5-9-10-11(6-2,7-3)8-4/h5-10H2,1-4H31H/q+1/p-1
(3)InChIKey: ZNFYPPCUDSCDPR-REWHXWOFAY
(4)Std. InChI: InChI=1S/C10H24N.BrH/c1-5-9-10-11(6-2,7-3)8-4/h5-10H2,1-4H31H/q+1/p-1
(5)Std. InChIKey: ZNFYPPCUDSCDPR-UHFFFAOYSA-M

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