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1-Chlorobutane CAS No.:109-69-3

1-Chlorobutane CAS No.:109-69-3

1-Chlorobutane, its cas register number is 109-69-3. It also can be called Butyl chloride; n-Butyl chloride; Butane, 1-chloro-; Chlorure de butyle; N-Propylcarbinyl chloride. It is a water white liquid with a sharp odor. It slightly soluble in water. Its vapors are heavier than air. It is highly...

1-Chlorobutane, its cas register number is 109-69-3. It also can be called Butyl chloride; n-Butyl chloride; Butane, 1-chloro-; Chlorure de butyle; N-Propylcarbinyl chloride. It is a water white liquid with a sharp odor. It slightly soluble in water. Its vapors are heavier than air. It is highly flammable. It may react with atmospheric moisture over prolonged periods of exposure.  1-Chlorobutane can be used in the manufacture of a variety of organic chemicals.


Physical properties about 1-Chlorobutane are: (1)ACD/LogP: 2.641; (2)ACD/LogD (pH 5.5): 2.64; (3)ACD/LogD (pH 7.4): 2.64; (4)ACD/BCF (pH 5.5): 59.91; (5)ACD/BCF (pH 7.4): 59.91; (6)ACD/KOC (pH 5.5): 651.58; (7)ACD/KOC (pH 7.4): 651.58; (8)#Freely Rotating Bonds: 2; (9)Index of Refraction: 1.396; (10)Molar Refractivity: 25.43 cm3; (11)Molar Volume: 105.947 cm3; (12)Polarizability: 10.081 10-24cm3; (13)Surface Tension: 22.1079998016357 dyne/cm; (14)Density: 0.874 g/cm3; (15)Flash Point: -6.667 °C ; (16)Enthalpy of Vaporization: 30.39 kJ/mol; (17)Boiling Point: 78.211 °C at 760 mmHg; (18)Vapour Pressure: 103.426002502441 mmHg at 25°C

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

1. Keep container in a well-ventilated place;

2. Keep away from sources of ignition - No smoking;

3. Do not empty into drains;

You can still convert the following datas into molecular structure:

(1)InChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3; 

(2)InChIKey=VFWCMGCRMGJXDK-UHFFFAOYSA-N; 

(3)SmilesC(CC)CCl;


The toxicity data is as follows:

Organism

Test Type

Route

Reported Dose (Normalized Dose)

Effect

Source

guinea pig

LD50

unreported

8gm/kg (8000mg/kg)


Vrachebnoe Delo. Medical Practice. Vol. (7), Pg. 105, 1979.

mouse

LD50

unreported

5600mg/kg (5600mg/kg)


Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 44(3), Pg. 11, 1979.

rabbit

LDLo

skin

20gm/kg (20000mg/kg)


"Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 745, 1969.

rat

LCLo

inhalation

8000ppm/4H (8000ppm)


AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

rat

LD50

oral

2670mg/kg (2670mg/kg)


AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

rat

LD50

unreported

2200mg/kg (2200mg/kg)


Vrachebnoe Delo. Medical Practice. Vol. (7), Pg. 105, 1979.

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