1-Butanaminium,N,N,N-triethyl-, bromide (1:1) (13028-69-8)

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