ChemicalBook--->CAS DataBase List--->94-99-5

94-99-5

94-99-5 Structure

94-99-5 Structure
IdentificationMore
[Name]

2,4-Dichlorobenzyl chloride
[CAS]

94-99-5
[Synonyms]

2,4-DCBC
2,4-DICHLOROBENZYL CHLORIDE
A 2,4-TRICHLOROTOLUENE
AKOS BBS-00004051
ALPHA,2,4-TRICHLOROTOLUENE
DICHLOROBENZYL-2,4 CHLORIDE
2,4-dichloro-1-(chloromethyl)-benzen
2,4-Dichloro-1-(chloromethyl)benzene
2,4-dichloro-1-chloromethyl-benzene
-2,4-Trichlorotoluene
benzene,2,4-dichloro-1-(chloromethyl)-
Toluene, alpha2,4-trichloro-
toluene,α,2,4-trichloro-
α,2,4-trichlorotoluene
2,4-dichlorobenzylchlorid
à,2,4-trichlorotoluene
2,4,ALPHA-TRICHLOROTOLUENE
2,4-Dichlorbenzylchlorid
2,4-Dichlorobenzoylchloride
7) 2,4-DI CHLORO BENZYL CHLORIDE
[EINECS(EC#)]

202-381-0
[Molecular Formula]

C7H5Cl3
[MDL Number]

MFCD00000895
[Molecular Weight]

195.47
[MOL File]

94-99-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to very light yellow oily liquid
[Melting point ]

-2.6 °C (lit.)
[Boiling point ]

248 °C (lit.)
[density ]

1.407 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.576(lit.)
[Fp ]

>230 °F
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly)
[form ]

Oily Liquid
[color ]

Clear colorless to very light yellow
[BRN ]

387220
[InChI]

InChI=1S/C7H5Cl3/c8-4-5-1-2-6(9)3-7(5)10/h1-3H,4H2
[InChIKey]

IRSVDHPYXFLLDS-UHFFFAOYSA-N
[SMILES]

C1(CCl)=CC=C(Cl)C=C1Cl
[LogP]

4.08
[CAS DataBase Reference]

94-99-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzene, 2,4-dichloro-1-(chloromethyl)-(94-99-5)
[EPA Substance Registry System]

94-99-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
[Hazard Codes ]

C,N
[Risk Statements ]

R34:Causes burns.
R37:Irritating to the respiratory system.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S60:This material and/or its container must be disposed of as hazardous waste .
[RIDADR ]

UN 3265 8/PG 2
[WGK Germany ]

3
[F ]

19
[Hazard Note ]

Corrosive
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29036990
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Chlorine-->AIBN-->2,4-Dichlorotoluene-->alpha,alpha,2,4-Tetrachlorotoluene-->2,4-Dichlorobenzonitrile-->1,3-Bis(chloromethyl)benzene-->2,4-Dichlorobenzoic acid-->2,4-Dichlorobenzyl alcohol-->Dichloromethane-->Phosphorus trichloride
[Preparation Products]

2,4-Dichlorobenzaldehyde-->alpha,alpha,2,4-Tetrachlorotoluene-->2,4-Dichlorophenylacetonitrile-->Lonidamine-->5-AMino-1-(2,4-dichlorobenzyl)-1H-indazol-3-ol-->1-((2,4-Dichlorobenzyl)amino)propan-2-ol-->N-(2,4-Dichlorobenzyl)-2-methoxyethanamine-->1-(4-Chlorophenyl)-2-(2,4-dichlorophenyl)ethanone
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,4-Dichlorobenzoylchloride(94-99-5).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to very light yellow oily liquid
[Uses]

2,4-Dichlorobenzyl chloride is a reagent used in the addition of dichlorobenzene.
[Synthesis]

2,4-Dichlorobenzyl alcohol

1777-82-8

2,4-Dichlorobenzyl chloride

94-99-5

GENERAL STEPS: 2,4-dichlorobenzyl alcohol (17.7 g, 0.1 mol), dichloromethane (30 mL), and N,N-dimethylformamide (DMF, 1 mL) were added to a 100 mL round-bottomed flask, followed by the slow dropwise addition of phosphorus trichloride (4.68 g, 0.034 mol). The reaction mixture was heated to reflux temperature (60-80°C) and the reaction lasted for 2-3 hours. The progress of the reaction was monitored by thin layer chromatography (TLC) until the complete disappearance of the raw material. After completion of the reaction, 2,4-dichlorobenzyl chloride (17.99 g, 92% yield) was purified by distillation.

[References]

[1] Patent: CN106117028, 2016, A. Location in patent: Paragraph 0053; 0054; 0055; 0056
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-Dichlorobenzyl chloride(94-99-5)MS
2,4-Dichlorobenzyl chloride(94-99-5)1HNMR
2,4-Dichlorobenzyl chloride(94-99-5)13CNMR
2,4-Dichlorobenzyl chloride(94-99-5)IR1
2,4-Dichlorobenzyl chloride(94-99-5)IR2
2,4-Dichlorobenzyl chloride(94-99-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,4-Dichlorobenzyl chloride, 99%(94-99-5)
[Alfa Aesar]

2,4-Dichlorobenzyl chloride, 98%(94-99-5)
[Sigma Aldrich]

94-99-5(sigmaaldrich)
[TCI AMERICA]

2,4-Dichlorobenzyl Chloride,>98.0%(GC)(94-99-5)
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