Conditions | Yield |
---|---|
With hydrogenchloride; ammonium chloride In water at 60 - 107℃; for 3h; | 97.2% |
With hydrogenchloride at 80℃; for 48h; | 10% |
With thionyl chloride |
cyclopropane
A
cyclopropyl chloride
B
1,1-dichlorocyclopropane
C
1,3-Dichloropropane
D
3-chloroprop-1-ene
Conditions | Yield |
---|---|
With chlorine; silicon tetrafluoride at 600℃; Product distribution; Irradiation; | A 83.5% B 4% C n/a D 2.6% |
Conditions | Yield |
---|---|
With tetrachloromethane; triphenylphosphine In acetonitrile Product distribution; Mechanism; | A 16% B 75% |
With hydrogenchloride at 100℃; | |
With hydrogenchloride | |
With tert-butylhypochlorite; triphenylphosphine In chloroform Product distribution; 1.) -70 deg C, 2.) RT, 3.) reflux, 24 h; |
cyclopropane
A
1,1,3-trichloropropane
B
1,2,3-trichloropropane
C
cyclopropyl chloride
D
1,1-dichlorocyclopropane
E
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine In trichlorofluoromethane at 21℃; for 0.0833333h; Product distribution; Mechanism; Irradiation; also 1,3-dichloropropane; var. solvents (also in the gas phase); | A 13% B 8.7% C 11% D 0.4% E 67% |
trimethyleneglycol
A
1,3-Dichloropropane
B
2-chloro-1,3,2-dioxaphosphinane
Conditions | Yield |
---|---|
With phosphorus trichloride In dichloromethane for 2h; Ambient temperature; | A n/a B 48% C 5% |
Conditions | Yield |
---|---|
With phosphorus pentachloride |
Conditions | Yield |
---|---|
With hydrogenchloride at 149 - 154℃; under 540598 - 680345 Torr; |
propane
A
1,2-Dichloropropane
B
2,2-dichloropropane
C
1,1-dichloropropane
D
1,3-Dichloropropane
Conditions | Yield |
---|---|
at 400℃; Product distribution; thermische Chlorierung; | |
at 400℃; Product distribution; thermische Chlorierung; |
ethene
dichloromethane
A
1,5-dichloropentane
B
1,3-Dichloropropane
Conditions | Yield |
---|---|
With water; dibenzoyl peroxide at 200℃; under 55163.1 - 73550.8 Torr; |
Conditions | Yield |
---|---|
With sulfuryl dichloride; 1,2-dichloro-benzene; dibenzoyl peroxide | |
With sulfuryl dichloride; dilauryl peroxide; chlorobenzene | |
With sulfuryl dichloride; dilauryl peroxide; 1,2-dichloro-benzene |
Conditions | Yield |
---|---|
With water; silver(I) chloride |
Conditions | Yield |
---|---|
With triphenyl phosphite at 170 - 180℃; |
ethanol
1,3-chlorobromopropane
A
1,3-Dichloropropane
B
1,3-dibromo-propane
Conditions | Yield |
---|---|
With antimonypentachloride | |
With mercury dichloride |
Conditions | Yield |
---|---|
With thionyl chloride |
phosgene
3-methoxypropylamine
1-Chloronaphthalene
A
3-Chloropropyl isocyanate
B
1,3-Dichloropropane
Conditions | Yield |
---|---|
at 140 - 150℃; das Hydrochlorid reagiert; |
1-Chloropropane
A
1,2-Dichloropropane
B
1,1-dichloropropane
C
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine In 1,2-dichloro-benzene at 0℃; Product distribution; oth. temperatures; | |
With N-chloropiperidine; 2,2'-azobis(isobutyronitrile) In trifluoroacetic acid at 30℃; Product distribution; Rate constant; Irradiation; relative rate constants, position selectivity, substrate selectivity; | |
With chlorine In benzene at -10.1℃; Product distribution; dependence of the selectivity of chlorination on the conc. of benzene; | |
With sulfuryl dichloride; dibenzoyl peroxide | |
With chlorine Ambient temperature; Irradiation; |
1,1,3-trichloropropane
1,3-Dichloropropane
Conditions | Yield |
---|---|
With triethylsilane; decacarbonyldirhenium(0) at 160℃; for 5h; | 48 % Chromat. |
With triethylsilane; Re(CO)10 at 159.9℃; for 5h; Rate constant; other catalyst, time, temperature; | 20 % Chromat. |
cyclopropane
A
hydrogenchloride
B
cyclopropyl chloride
C
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine at -263.2℃; Quantum yield; Irradiation; further temps.; |
Conditions | Yield |
---|---|
With hydrogenchloride; ammonium chloride In water at 60 - 107℃; for 3h; | 97.2% |
With hydrogenchloride at 80℃; for 48h; | 10% |
With thionyl chloride |
cyclopropane
A
cyclopropyl chloride
B
1,1-dichlorocyclopropane
C
1,3-Dichloropropane
D
3-chloroprop-1-ene
Conditions | Yield |
---|---|
With chlorine; silicon tetrafluoride at 600℃; Product distribution; Irradiation; | A 83.5% B 4% C n/a D 2.6% |
Conditions | Yield |
---|---|
With tetrachloromethane; triphenylphosphine In acetonitrile Product distribution; Mechanism; | A 16% B 75% |
With hydrogenchloride at 100℃; | |
With hydrogenchloride | |
With tert-butylhypochlorite; triphenylphosphine In chloroform Product distribution; 1.) -70 deg C, 2.) RT, 3.) reflux, 24 h; |
cyclopropane
A
1,1,3-trichloropropane
B
1,2,3-trichloropropane
C
cyclopropyl chloride
D
1,1-dichlorocyclopropane
E
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine In trichlorofluoromethane at 21℃; for 0.0833333h; Product distribution; Mechanism; Irradiation; also 1,3-dichloropropane; var. solvents (also in the gas phase); | A 13% B 8.7% C 11% D 0.4% E 67% |
trimethyleneglycol
A
1,3-Dichloropropane
B
2-chloro-1,3,2-dioxaphosphinane
Conditions | Yield |
---|---|
With phosphorus trichloride In dichloromethane for 2h; Ambient temperature; | A n/a B 48% C 5% |
Conditions | Yield |
---|---|
With phosphorus pentachloride |
Conditions | Yield |
---|---|
With hydrogenchloride at 149 - 154℃; under 540598 - 680345 Torr; |
propane
A
1,2-Dichloropropane
B
2,2-dichloropropane
C
1,1-dichloropropane
D
1,3-Dichloropropane
Conditions | Yield |
---|---|
at 400℃; Product distribution; thermische Chlorierung; | |
at 400℃; Product distribution; thermische Chlorierung; |
ethene
dichloromethane
A
1,5-dichloropentane
B
1,3-Dichloropropane
Conditions | Yield |
---|---|
With water; dibenzoyl peroxide at 200℃; under 55163.1 - 73550.8 Torr; |
Conditions | Yield |
---|---|
With sulfuryl dichloride; 1,2-dichloro-benzene; dibenzoyl peroxide | |
With sulfuryl dichloride; dilauryl peroxide; chlorobenzene | |
With sulfuryl dichloride; dilauryl peroxide; 1,2-dichloro-benzene |
Conditions | Yield |
---|---|
With water; silver(I) chloride |
Conditions | Yield |
---|---|
With triphenyl phosphite at 170 - 180℃; |
ethanol
1,3-chlorobromopropane
A
1,3-Dichloropropane
B
1,3-dibromo-propane
Conditions | Yield |
---|---|
With antimonypentachloride | |
With mercury dichloride |
Conditions | Yield |
---|---|
With thionyl chloride |
phosgene
3-methoxypropylamine
1-Chloronaphthalene
A
3-Chloropropyl isocyanate
B
1,3-Dichloropropane
Conditions | Yield |
---|---|
at 140 - 150℃; das Hydrochlorid reagiert; |
1-Chloropropane
A
1,2-Dichloropropane
B
1,1-dichloropropane
C
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine In 1,2-dichloro-benzene at 0℃; Product distribution; oth. temperatures; | |
With N-chloropiperidine; 2,2'-azobis(isobutyronitrile) In trifluoroacetic acid at 30℃; Product distribution; Rate constant; Irradiation; relative rate constants, position selectivity, substrate selectivity; | |
With chlorine In benzene at -10.1℃; Product distribution; dependence of the selectivity of chlorination on the conc. of benzene; | |
With sulfuryl dichloride; dibenzoyl peroxide | |
With chlorine Ambient temperature; Irradiation; |
1,1,3-trichloropropane
1,3-Dichloropropane
Conditions | Yield |
---|---|
With triethylsilane; decacarbonyldirhenium(0) at 160℃; for 5h; | 48 % Chromat. |
With triethylsilane; Re(CO)10 at 159.9℃; for 5h; Rate constant; other catalyst, time, temperature; | 20 % Chromat. |
cyclopropane
A
hydrogenchloride
B
cyclopropyl chloride
C
1,3-Dichloropropane
Conditions | Yield |
---|---|
With chlorine at -263.2℃; Quantum yield; Irradiation; further temps.; |
1,3-chlorobromopropane
A
1,2-Dichloropropane
B
1,2-Dibromopropane
C
1,3-Dichloropropane
D
allyl bromide
E
1,3-dibromo-propane
F
3-chloroprop-1-ene
Conditions | Yield |
---|---|
aluminum oxide at 160℃; Mechanism; Product distribution; different temperature; |
trimethylene oxide
phosphorus pentachloride
1,3-Dichloropropane
2-methyl-[1,3]dioxane
phosphorus pentachloride
A
1,3-Dichloropropane
B
acetaldehyde
Conditions | Yield |
---|---|
With diethyl ether |
1,3-Dichloropropane
Conditions | Yield |
---|---|
beim Chlorieren; |
Conditions | Yield |
---|---|
With chlorine at 340℃; | |
With chlorine at 100℃; in der Gasphase unter der Einwirkung von Licht; | |
With chlorine at -78℃; in der fluessiger Phase unter der Einwirkung von Licht; |
Conditions | Yield |
---|---|
With chlorine at 400℃; | |
With tetrachloromethane; chlorine at 200℃; under 29420.3 - 36775.4 Torr; | |
With chlorine at 400℃; |
hydrogenchloride
3-chloroprop-1-ene
dibenzoyl peroxide
A
1,2-Dichloropropane
B
1,3-Dichloropropane
Conditions | Yield |
---|---|
In tetrahydrofuran; diethyl ether addn. of 1,3-dichloropropane in THF over 30 min to a (c-C6H11)2SbLi soln. in ether at -45°C; mixt. treated with aq. NH4Cl, evapn. of the ether; | 99% |
In tetrahydrofuran; diethyl ether addn. of 1,3-dichloropropane in THF over 30 min to a (c-C6H11)2SbLi soln. in ether at -45°C; mixt. treated with aq. NH4Cl, evapn. of the ether; | 99% |
Conditions | Yield |
---|---|
In chloroform at 60℃; under 14251400 Torr; for 24h; Pressure; Menshutkin Reaction; High pressure; Autoclave; | 99% |
at 110℃; for 6h; neat (no solvent); | 92% |
In methanol for 24h; Reflux; | |
In methanol for 24h; Reflux; |
Conditions | Yield |
---|---|
In chloroform at 60℃; under 14251400 Torr; for 24h; Kinetics; Pressure; Time; Menshutkin Reaction; High pressure; Autoclave; | 99% |
1,3-Dichloropropane
dicyclohexylphosphane
1,3-bis(dicyclohexylphosphine)propane
Conditions | Yield |
---|---|
Stage #1: dicyclohexylphosphane With n-butyllithium In tetrahydrofuran at -78 - 20℃; for 1.25h; Inert atmosphere; Schlenk technique; Stage #2: 1,3-Dichloropropane In tetrahydrofuran at -78 - 20℃; for 2h; Inert atmosphere; Schlenk technique; | 97% |
phthalimide
ethyl acetoacetate
1,3-Dichloropropane
ethyl 2-acetyl-5-(1,3-dioxo-1,3-dihydro-2-isoindolyl)pentanoate
Conditions | Yield |
---|---|
Stage #1: phthalimide With potassium carbonate In acetonitrile at 20℃; for 0.5h; Stage #2: 1,3-Dichloropropane With sodium iodide In acetonitrile at 58 - 60℃; for 5.5h; Stage #3: ethyl acetoacetate In acetonitrile at 20℃; for 7h; Reagent/catalyst; | 96.2% |
theobromine /
1,3-Dichloropropane
1-(3-chloropropyl)-3,7-dimethyl-2,3,6,7-tetrahydro-1H-2,6-purinedione
Conditions | Yield |
---|---|
With sodium hydroxide; N-benzyl-N,N,N-triethylammonium chloride for 2h; Heating; | 96% |
Conditions | Yield |
---|---|
tetrabutylammomium bromide at 115℃; for 1.5h; | 96% |
1,3-Dichloropropane
1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione
Conditions | Yield |
---|---|
With tetrabutylammomium bromide In dimethyl sulfoxide at 80℃; | 96% |
4-Methoxyphenylacetic acid
1,3-Dichloropropane
3-chloropropyl 2-(4-methoxyphenyl)acetate
Conditions | Yield |
---|---|
With potassium carbonate In dimethyl sulfoxide at 45℃; for 3h; | 96% |
dimethylenecyclourethane
1,3-Dichloropropane
3-(3-chloro-1-propyl)-2-oxazolidinone
Conditions | Yield |
---|---|
With NaH In dichloromethane; N,N-dimethyl-formamide | 95% |
sodium p-aminobenzoate
1,3-Dichloropropane
propane-1,3-diyl bis(4-aminobenzoate)
Conditions | Yield |
---|---|
In N-methyl-acetamide; water | 95% |
With sodium carbonate; dimethyl sulfoxide; 1,2-dichloro-ethane In water | 91.5% |
The IUPAC name of this product is 1,3-dichloropropane. With the CAS registry number 142-28-9, it is also named as Trimethylene dichloride; Propane, 1,3-dichloro-. The product's categories are alpha,omega-bifunctional alkanes; alpha,omega-dichloroalkanes; monofunctional & alpha,omega-bifunctional alkanes; analytical chemistry; standard solution of volatile organic compounds for water & soil analysis; standard solutions (VOC); volatiles / semivolatiles. It is clear colourless liquid with a sweet odor. And it is highly flammable, so keep it away from sources of ignition. In addition, 1,3-Dichloropropane belongs to halogenated aliphatic compounds which are moderately or very reactive. Reactivity generally decreases with increased degree of substitution of halogen for hydrogen atoms. This material is incompatible with strong oxidizing and reducing agents. Also, it is incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 19.51; (6)ACD/BCF (pH 7.4): 19.51; (7)ACD/KOC (pH 5.5): 291.83; (8)ACD/KOC (pH 7.4): 291.83; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)Index of Refraction: 1.422; (12)Molar Refractivity: 25.64 cm3; (13)Molar Volume: 100.8 cm3; (14)Polarizability: 10.16×10-24 cm3; (15)Surface Tension: 26.3 dyne/cm; (16)Enthalpy of Vaporization: 35.18 kJ/mol; (17)Vapour Pressure: 18.3 mmHg at 25°C; (18)Rotatable Bond Count: 2; (19)Exact Mass: 111.984656; (20)MonoIsotopic Mass: 111.984656; (21)Heavy Atom Count: 5.
Uses of 1,3-Dichloropropane: It can be used for organic synthesis intermediates and solvents. And it is also used as standard materials of solvent, detergent and chromatographic analysis. In addition, it reacts with mercaptoacetic acid to get 3,7-dithia-nonanedioic acid. This reaction needs reagent NaOH and solvent H2O
ethanol by heating. The reaction time is 16 hours. The yield is 74 %.
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. And it is also irritating to eyes, respiratory system and skin. Furthermore, it is harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment, so people should avoid release to the environment. 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 and gloves. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
People can use the following data to convert to the molecule structure.
1. SMILES: ClCCCCl;
2. InChI: InChI=1/C3H6Cl2/c4-2-1-3-5/h1-3H2.
The following are the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LDLo | oral | 3gm/kg (3000mg/kg) | LUNGS, THORAX, OR RESPIRATION: CHRONIC PULMONARY EDEMA LIVER: OTHER CHANGES BLOOD: HEMORRHAGE | American Journal of Hygiene. Vol. 16, Pg. 325, 1932. |
mouse | LD50 | unreported | 3600mg/kg (3600mg/kg) | GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE | Eisei Kagaku. Hygienic Chemistry. Vol. 28, Pg. P31, 1982. |
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View