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Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1)

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Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1)

EINECS 217-475-7
CAS No. 1866-16-6 Density 1.3969 (estimate)
PSA 42.37000 LogP -1.24350
Solubility almost transparency Melting Point 171-174 ºC
Formula C9H20INOS Boiling Point N/A
Molecular Weight 317.234 Flash Point N/A
Transport Information N/A Appearance white crystals or crystalline powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 1866-16-6 (S-BUTYRYLTHIOCHOLINE IODIDE) Hazard Symbols IrritantXi
Synonyms

N,N,N-Trimethyl-2-[(1-oxobutyl)thio]-ethanaminiuiodide;

Article Data 3

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Chemical Properties

 

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Uses

 

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Production

 

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Toxicity Data With Reference

 

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Safety Profile

 

Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) Specification

The Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1), with the CAS registry number 1866-16-6, is also known as N,N,N-Trimethyl-2-[(1-oxobutyl)thio]-ethanaminiuiodide. It belongs to the product categories of Ammonium Iodides (Quaternary); Quaternary Ammonium Compounds. Its EINECS registry number is 217-475-7. This chemical's molecular formula is C9H20INOS and molecular weight is 317.2307. What's more, its IUPAC name is 2-Butanoylsulfanylethyl(trimethyl)azanium iodide.

Physical properties about Ethanaminium,N,N,N-trimethyl-2-[(1-oxobutyl)thio]-, iodide (1:1) are: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 42.37 Å2.When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [I-].C[N+](C)(C)C(C)SC(=O)CCC
(2) InChI: InChI=1/C9H20NOS.HI/c1-6-7-9(11)12-8(2)10(3,4)5;/h8H,6-7H2,1-5H3;1H/q+1;/p-1
(3) InChIKey: IYNXNSQJLCWMOU-REWHXWOFAW

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