CAS No.1871-57-4,2-(CHLOROMETHYL)ALLYLTRICHLOROSILANE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	1871-57-4
Name:	2-(CHLOROMETHYL)ALLYLTRICHLOROSILANE
Article Data:	35
Cas Database

Formula:	C₄H₆Cl₂
Molecular Weight:	124.998
Synonyms:	Propene,3-chloro-2-(chloromethyl)- (6CI,7CI,8CI);1,1-Bis(chloromethyl)ethene;1,3-Dichloro-2-methylenepropane;2-(Chloromethyl)allyl chloride;2-Chloromethyl-2-propenyl chloride;2-Chloromethyl-3-chloro-1-propene;2-Chloromethyl-3-chloropropene;2-Methylene-1,3-dichloropropane;2-Methylenepropane-1,3-dichloride;NSC 88138;
EINECS:	217-489-3
Density:	1.114 g/cm³
Melting Point:	14 °C
Boiling Point:	137.999 °C at 760 mmHg
Flash Point:	36.667 °C
Appearance:	clear colorless to yellow liquid
Hazard Symbols:	T,Xi,F
Risk Codes:	14-34-36/37/38-25-10
Safety:	26-27-36/37/39-45-16
PSA:	0.00000
LogP:	2.02020

Synthetic route

: 17831-70-8
3-chloro-2,2-bis(chloromethyl)propionic acid-1

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
at 205 - 215℃; Pyrolysis;	99%
With quinoline
at 200 - 220℃; in presence of quinoline the pyrolysis begins at 100 deg C.; Yield given;
at 210℃; Yield given;

: 66703-69-3
1,3-dichloro-2-chloromethylpropane

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene 70 deg C, 24 h; 190 deg C;	80%

: 2210-05-1
5,5-dichloromethyl-2-thia-1,3-dioxane 2-oxide

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
at 500℃; under 1 Torr; Inert atmosphere; Pyrolysis;	65%

: 3513-81-3
2-(Hydroxymethyl)allyl alcohol

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
With pyridine; thionyl chloride In dichloromethane for 3h; Reflux;	32%
With pyridine; thionyl chloride; chloroform

: 2,2-bis(chloromethyl)aziridine

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
With hydrogenchloride; sodium nitrite In water at 5 - 50℃; for 5h; Large scale;	29.1%
With hydrogenchloride; sodium nitrite at 20 - 50℃; Ring cleavage; elimination;	85.0 g

: 91-22-5
quinoline

: 17831-70-8
3-chloro-2,2-bis(chloromethyl)propionic acid-1

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

: 597-32-0
1,3-dichloro-2-methyl-propan-2-ol

A: 3375-22-2
1,3-dichloro-2-methylpropene

B: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
With sulfuric acid at 100℃; 1,3-dichloro-2-methyl-propene of uncertain stereochemical membership;

: 597-32-0
1,3-dichloro-2-methyl-propan-2-ol

: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
With sulfuric acid at 100℃;

: 1871-58-5
1,2,3-trichloro-2-methylpropane

A: 3375-22-2
1,3-dichloro-2-methylpropene

B: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

Conditions

Conditions	Yield
at 450 - 460℃;

: 79437-10-8
1-chloro-2,2-di(chloromethyl)-2-nitroethane

A: 1871-57-4
2-chloromethyl-3-chloroprop-1-ene

B: 13245-65-3
1,3-dichloro-2-chloromethyl-1-propene

Conditions

Conditions	Yield
With sodium amalgam

Raw Materials

56-23-5

597-32-0

513-37-1

115-11-7

Downstream Products

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Specification

The 1-Propene,3-chloro-2-(chloromethyl)-, with the CAS registry number 1871-57-4, is also known as 1,3-Dichloro-2-methylenepropane. Its EINECS registry number is 217-489-3. This chemical's molecular formula is C₄H₆Cl₂ and molecular weight is 125. What's more, both its IUPAC name and systematic name are the same which is called 3-Chloro-2-(chloromethyl)prop-1-ene. It is clear colorless to yellow liquid.

Physical properties about 1-Propene,3-chloro-2-(chloromethyl)- are: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/LogD (pH 7.4): 2.29; (5)ACD/BCF (pH 5.5): 32.53; (6)ACD/BCF (pH 7.4): 32.53; (7)ACD/KOC (pH 5.5): 420.82; (8)ACD/KOC (pH 7.4): 420.82; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.444; (14)Molar Refractivity: 29.84 cm³; (15)Molar Volume: 112.2 cm³; (16)Surface Tension: 25.9 dyne/cm; (17)Density: 1.113 g/cm³; (18)Flash Point: 36.7 °C; (19)Enthalpy of Vaporization: 35.98 kJ/mol; (20)Boiling Point: 138 °C at 760 mmHg; (21)Vapour Pressure: 8.53 mmHg at 25 °C; (22)Melting Point: 14 °C.

Uses of 1-Propene,3-chloro-2-(chloromethyl)-: it is used to produce other chemicals. For example, it is used to produce 2-Methylene-propane-1,3-diol. This reaction needs reagent KOH, solvent H₂O and other condition of heating for 40 hours.

1-Propene,3-chloro-2-(chloromethyl)- is used to produce 2-Methylene-propane-1,3-diol.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. It may catch fire in contact with air, only need brief contact with an ignition source and have a very low flash point or evolve highly flammable gases in contact with water. In addition, it reacts violently with water and may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. What's more, you should keep away from sources of ignition. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. And in case of accident or if you feel unwell seek medical advice immediately.

You can still convert the following datas into molecular structure:
(1) SMILES: ClC/C(=C)CCl
(2) InChI: InChI=1/C4H6Cl2/c1-4(2-5)3-6/h1-3H2
(3) InChIKey: XJFZOSUFGSANIF-UHFFFAOYAU

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mammal (species unspecified)	LC50	inhalation	400mg/m³/4H (400mg/m³)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Farmakologiya i Toksikologiya Vol. 5, Pg. 157, 1970.
mouse	LD50	oral	250mg/kg (250mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Farmakologiya i Toksikologiya Vol. 5, Pg. 157, 1970.
rat	LD50	oral	150mg/kg (150mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Farmakologiya i Toksikologiya Vol. 5, Pg. 157, 1970.