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1-Bromotetradecane CAS No.:112-71-0

1-Bromotetradecane CAS No.:112-71-0

1-Bromotetradecane Specification The IUPAC name of Tetradecane, 1-bromo- is 1-bromotetradecane. With the CAS registry number 112-71-0, it is also named as Myristyl bromide; 1-Tetradecyl bromide. The product's categories are alkyl bromides; monofunctional & alpha,omega-bifunctional...

Name

1-Bromotetradecane

EINECS

203-999-3

CAS No.

112-71-0

Density

0.93 g/cm3

Solubility

insoluble in water

Melting Point

5-6 °C(lit.)

Formula

C14H29Br

Boiling Point

307.5 °C at 760 mmHg

Molecular Weight

277.29

Flash Point

127.3 °C

Transport Information


Appearance

pale yellow liquid

Safety

26-36-24/25

Risk Codes

36/37/38

Molecular Structure

1.jpg

Hazard Symbols

3(001).jpgXi

Synonyms

1-Tetradecyl bromide;Myristyl bromide;NSC 83468;Tetradecyl bromide;n-Tetradecyl bromide;n-Tetradecyl-1-bromide;




1-Bromotetradecane Specification

The IUPAC name of Tetradecane, 1-bromo- is 1-bromotetradecane. With the CAS registry number 112-71-0, it is also named as Myristyl bromide; 1-Tetradecyl bromide. The product's categories are alkyl bromides; monofunctional & alpha,omega-bifunctional alkanes; monofunctional alkanes. It is pale yellow liquid which is stable and incompatible with strong bases, strong oxidizing agents. In addition, this chemical can be obtained from tetradecyl alchohol by bromination.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 4.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.34; (4)ACD/LogD (pH 7.4): 4.34; (5)ACD/BCF (pH 5.5): 1162.76; (6)ACD/BCF (pH 7.4): 1162.76; (7)ACD/KOC (pH 7.4): 5443.48; (8)#H bond acceptors: 0; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.449; (12)Molar Refractivity: 42.21 cm3; (13)Molar Volume: 157.2 cm3; (14)Surface Tension: 28.3 dyne/cm; (15)Enthalpy of Vaporization: 39.79 kJ/mol; (16)Vapour Pressure: 1.32 mmHg at 25°C; (17)Rotatable Bond Count: 12; (18)Exact Mass: 276.145264; (19)MonoIsotopic Mass: 276.145264; (20)Heavy Atom Count: 15.

Uses: Used in organic synthesis. For example: It can react with piperazine to get 1,4-ditetradecyl-piperazine. This reaction needs reagent K2CO3 and solvent acetonitrile at temperature of 100 - 110 °C. The reaction time is 1.5 hours. The yield is 84 %.

1.jpg


When you are using this chemical, please be cautious about it as the following:

It is irritating to eyes, respiratory system and skin, so people should avoid contact with skin and eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing. 

People can use the following data to convert to the molecule structure. 

1. SMILES: BrCCCCCCC;

2. InChI: InChI=1/C7H15Br/c1-2-3-4-5-6-7-8/h2-7H2,1H3.


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