CAS No.109-69-3,1-Chlorobutane Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	109-69-3
Name:	1-Chlorobutane
Article Data:	278

Formula:	C₄H₉Cl
Molecular Weight:	92.5685
Synonyms:	Butyl chloride;Chlorobutane;NSC 8419;n-Butyl chloride;n-Chlorobutane;n-Propylcarbinyl chloride;Butane,1-chloro-;
EINECS:	203-696-6
Density:	0.873 g/cm³
Melting Point:	-123 °C
Boiling Point:	78.2 °C at 760 mmHg
Flash Point:	12 °F
Solubility:	Insoluble
Appearance:	water white liquid with a sharp odor
Hazard Symbols:	F
Risk Codes:	11
Safety:	9-16-29
PSA:	0.00000
LogP:	2.02530

Synthetic route

: 71-36-3
butan-1-ol

A: 126-73-8
phosphoric acid tributyl ester

B: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
With hydrogenchloride; water; oxygen; copper dichloride at 59.9℃; Product distribution; Mechanism; other alcohols, var. conc. of reagents, var. temperat.;	A 100% B n/a
With phosphan; chlorine Rate constant; Thermodynamic data; Ea, ΔS(excit.); also in the presence of pyridine;

: 592-34-7
carbonochloridic acid, butyl ester

: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
With hexabutylguanidinium chloride at 100℃; for 0.05h;	100%

: 542-69-8
1-iodo-butane

: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
With phosphorus pentachloride; trichlorophosphate for 0.5h; Heating; other alkyl and aryl iodides;	98%
With mercury dichloride

: 71-36-3
butan-1-ol

: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
With hydrogenchloride In water at 115℃; for 2h; Reagent/catalyst; Temperature;	96.9%
With hydrogenchloride; dimethyl sulfoxide In water at 85 - 95℃; for 20h; Temperature; Reagent/catalyst;	93.5%
With hydrogenchloride at 75 - 80℃; Concentration;	91.5%

: 71-36-3
butan-1-ol

A: 109-69-3
n-Butyl chloride

B: 142-96-1
dibutyl ether

Conditions

Conditions	Yield
With hydrogenchloride; tetrabutylphosphonium ion; silica gel at 170℃; under 760 Torr;	A 95% B 4 % Chromat.

n-butylbis(dimethylglyoximato)pyridinecobalt(III): n-butylbis(dimethylglyoximato)pyridinecobalt(III)

A: 109-69-3
n-Butyl chloride

B: 2386-60-9
perfluoro-1-butanesulfonyl fluoride

C chlorobis(dimethylglyoximato)pyridinecobalt(III): chlorobis(dimethylglyoximato)pyridinecobalt(III)

Conditions

Conditions	Yield
With Trichloromethanesulfonyl chloride In dichloromethane at 18℃; for 3.5h; Irradiation;	A n/a B 95% C n/a

...Expand

: 2712-93-8
dichlorofluoromethanesulphenyl chloride

: 106-97-8
n-butane

A: 109-69-3
n-Butyl chloride

B: 675-63-8
bis(dichlorofluoromethyl)disulfane

C: 68409-15-4
2-(Dichloro-fluoro-methylsulfanyl)-butane

Conditions

Conditions	Yield
	A 8.5% B 92.4% C 2.3%
	A 8.5% B 92.4% C 2.3%

...Expand

: 17487-60-4
1,1-dibutoxy-2,2-dichloro-ethene

A: 109-69-3
n-Butyl chloride

B: 118487-59-5
butoxycarbonyldichloromethanesulfenyl chloride

Conditions

Conditions	Yield
With sulfur monochloride In dichloromethane under Ar atmosphere, spontaneous heating to 45 deg C 30 min, 20 deg C 2,5 h;	A n/a B 90%

: 71-36-3
butan-1-ol

A: 126-73-8
phosphoric acid tributyl ester

B: 109-69-3
n-Butyl chloride

C: 142-96-1
dibutyl ether

Conditions

Conditions	Yield
With oxygen; phosphan; copper(l) chloride; copper dichloride at 24.9℃; Kinetics; Product distribution; Mechanism; ΔE(excit.), ΔS(excit.); other reagents, other catalysts;	A 90% B n/a C n/a
With oxygen; phosphan; copper(l) chloride; copper dichloride at 24.9℃;	A 90% B n/a C n/a

...Expand

: 56-23-5
tetrachloromethane

: 629-35-6
dibutylmercury

A: mercury(I) chloride

B: 109-69-3
n-Butyl chloride

C: 67-66-3
chloroform

D: 543-63-5
n-butylmercuric chloride

E: mercury

Conditions

Conditions	Yield
In neat (no solvent) 150°C, 25 h; further products;	A 2% B 87% C 105 % D 7% E 89%

...Expand

Raw Materials

75-09-2

2492-36-6

7732-18-5

688-74-4

67-56-1

84-74-2

98-59-9

109-21-7

Downstream Products

109-52-4

542-69-8

106-98-9

3405-45-6

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Specification

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)	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.