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| CAS No.: | 3720-84-1 |
|---|---|
| Name: | (3-Bromopropyl)triethylammonium bromide |
| Article Data: | 12 |
| Molecular Structure: | |
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| Formula: | C9H21Br2N |
| Molecular Weight: | 303.08 |
| Synonyms: | (3-Bromopropyl)triethylammoniumbromide (7CI);1-Propanaminium, 3-bromo-N,N,N-triethyl-, bromide (9CI);Ammonium, (3-bromopropyl)triethyl-, bromide (8CI); |
| Melting Point: | 137-139 °C(lit.) |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| PSA: | 0.00000 |
| LogP: | -0.34810 |
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Specification
The (3-Bromopropyl)triethylammonium bromide, with CAS registry number 3720-84-1, belongs to the following product categories: (1)B; (2)Stains and Dyes; (3)Stains&Dyes, A to. It has the systematic name of 3-bromo-N,N,N-triethylpropan-1-aminium bromide. And the chemical formula of this chemical is C9H21Br2N.
Physical properties of (3-Bromopropyl)triethylammonium bromide: (1)#H bond acceptors: 1; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 6.
Preparation: this chemical can be prepared by 1,3-dibromo-propane and triethylamine. This reaction will need reagent substitution and solvent acetic anhydride. The reaction temperature is 60 ℃. The yield is about 78%.
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Uses of (3-Bromopropyl)triethylammonium bromide: it can be used to produce C15H28N2(2+).2Br(1-). The reaction time is 2 hour(s) with reaction temperature of 140 ℃. The yield is about 72.1%.
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When you are using this chemical, please be cautious about it as the following:
The (3-Bromopropyl)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.
You can still convert the following datas into molecular structure:
(1)SMILES: [Br-].CC[N+](CC)(CCCBr)CC
(2)InChI: InChI=1/C9H21BrN.BrH/c1-4-11(5-2,6-3)9-7-8-10;/h4-9H2,1-3H3;1H/q+1;/p-1
(3)InChIKey: FNKGNRUAIHVWNL-REWHXWOFAV
(4)Std. InChI: InChI=1S/C9H21BrN.BrH/c1-4-11(5-2,6-3)9-7-8-10;/h4-9H2,1-3H3;1H/q+1;/p-1
(5)Std. InChIKey: FNKGNRUAIHVWNL-UHFFFAOYSA-M