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693-58-3

Basic Information
CAS No.: 693-58-3
Name: 1-Bromononane
Article Data: 34
Molecular Structure:
Molecular Structure of 693-58-3 (1-Bromononane)
Formula: C9H19 Br
Molecular Weight: 207.154
Synonyms: 1-Bromo-n-nonane;Nonane, 1-bromo-;1-Nonyl bromide;1-n-Nonyl bromide;NSC 5519;Nonyl bromide;n-Nonyl bromide;
EINECS: 211-755-2
Density: 1.089 g/cm3
Melting Point: -29oC
Boiling Point: 221.569 °C at 760 mmHg
Flash Point: 90 °C
Solubility: Soluble in ethyl ether and benzene, insoluble in water.
Appearance: colourless liquid
Hazard Symbols: HarmfulXn,IrritantXi
Risk Codes: 20-36/37/38
Safety: 23-24/25-37/39-26
PSA: 0.00000
LogP: 4.13190
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Specification

1-Bromononane is an organic compound with the formula C9H19Br, and its systematic name is the same with the product name. With the CAS registry number 693-58-3, it is also named as n-Nonyl bromide. It belongs to the product categories of Bromine Compounds; Alkyl Bromides; Monofunctional & alpha,omega-Bifunctional Alkanes; Monofunctional Alkanes. Its EINECS number is 211-755-2. In addition, the molecular weight is 207.15. This chemcial should be sealed and stored in a cool, ventilated and dry place. Moreover, it should be protected from light, heat and fire. This chemical should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxides and light. It is used in organic synthesis.

Physical properties of 1-Bromononane are: (1)ACD/LogP: 5.376; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.38; (4)ACD/LogD (pH 7.4): 5.38; (5)ACD/BCF (pH 5.5): 7170.01; (6)ACD/BCF (pH 7.4): 7170.01; (7)ACD/KOC (pH 5.5): 20015.76; (8)ACD/KOC (pH 7.4): 20015.76; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.453; (13)Molar Refractivity: 51.477 cm3; (14)Molar Volume: 190.278 cm3; (15)Polarizability: 20.407×10-24cm3; (16)Surface Tension: 29.2 dyne/cm; (17)Density: 1.089 g/cm3; (18)Flash Point: 90 °C; (19)Enthalpy of Vaporization: 43.937 kJ/mol; (20)Boiling Point: 221.569 °C at 760 mmHg; (21)Vapour Pressure: 0.16 mmHg at 25°C.

Preparation of 1-Bromononane: this chemical can be prepared by nonan-1-ol by heating. This reaction will need reagents Chlorotrimethylsilane, lithium bromide and solvent acetonitrile with the reaction time of 20 hours. The yield is about 95%.

1-Bromononane can be prepared by nonan-1-ol by heating

Uses of 1-Bromononane: it can be used to produce chlorodiethylisopropylsilane dinonyldisulfane at the ambient temperature. It will need reagents sulfur, Li2S, N-acetyl-N,N,N-trimethylammonium bromide and solvents H2O, CHCl3 with the reaction time of 6 hours. The yield is about 85%.

1-Bromononane can be used to produce chlorodiethylisopropylsilane dinonyldisulfane at the ambient temperature

When you are using this chemical, please be cautious about it as the following:
This chemcial is irritating to eyes, respiratory system and skin. It is harmful by inhalation. You should not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer). In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you must avoid contact with skin and eyes, and need to wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCCCCCCCCC
(2)Std. InChI: InChI=1S/C9H19Br/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3
(3)Std. InChIKey: AYMUQTNXKPEMLM-UHFFFAOYSA-N