ChemicalBook--->CAS DataBase List--->625-99-0

625-99-0

625-99-0 Structure

625-99-0 Structure
IdentificationMore
[Name]

1-Chloro-3-iodobenzene
[CAS]

625-99-0
[Synonyms]

1-CHLORO-3-IODOBENZENE
3-CHLOROIODOBENZENE
M-CHLOROIODOBENZENE
M-IODOCHLOROBENZENE
1-chloro-3-iodo-benzen
3-Chloro-1-iodobenzene
3-Iodochlorobenzene
m-Chlorophenyl iodide
1-Chloro-3-iodobenzene,98%
1-Chloro-3-iodopropane 98% stabilized
3-Chloroiodobenzene (stabilized with Copper chip)
1-Iodo-3-chlorobenzene
[EINECS(EC#)]

210-920-6
[Molecular Formula]

C6H4ClI
[MDL Number]

MFCD00001046
[Molecular Weight]

238.45
[MOL File]

625-99-0.mol
Chemical PropertiesBack Directory
[Appearance]

Clear light yellow liquid
[Melting point ]

95-96 °C
[Boiling point ]

103-104 °C15 mm Hg(lit.)
[density ]

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

n20/D 1.631(lit.)
[Fp ]

215 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

Liquid
[color ]

Clear light yellow
[Specific Gravity]

1.926
[Water Solubility ]

Soluble in water 67.2 mg/L.
[Sensitive ]

Light Sensitive
[BRN ]

1904539
[InChI]

1S/C6H4ClI/c7-5-2-1-3-6(8)4-5/h1-4H
[InChIKey]

JMLWXCJXOYDXRN-UHFFFAOYSA-N
[SMILES]

Clc1cccc(I)c1
[CAS DataBase Reference]

625-99-0(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzene, 1-chloro-3-iodo-(625-99-0)
[EPA Substance Registry System]

625-99-0(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29039990
[Storage Class]

10 - Combustible liquids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Chloroiodobenzene(625-99-0).msds
Hazard InformationBack Directory
[Chemical Properties]

Clear light yellow liquid
[Uses]

suzuki reaction
[Synthesis Reference(s)]

Synthetic Communications, 11, p. 639, 1981 DOI: 10.1080/00397918108063637
[General Description]

The multiple-quantum proton NMR spectra of 3-chloroiodobenzene was studied.
[Synthesis]

3-Chlorophenylboronic acid

63503-60-6

1-Chloro-3-iodobenzene

625-99-0

General procedure for the synthesis of m-chloroiodobenzene from 3-chlorophenylboronic acid: a mixture of arylboronic acid (0.55 mmol), KF (96 mg, 1.65 mmol) and I2 (127 mg, 0.50 mmol) in 1,4-dioxane (5 mL) was stirred and reacted for 1 hr at 80 °C. After completion of the reaction, the mixture was filtered through a silica gel column and eluted with ether (10 mL). Subsequently, the solvent was removed by rotary evaporator. For further purification, the target product, m-chloroiodobenzene, was isolated by silica gel column chromatography using petroleum ether/ether (98:2) as eluent.

[References]

[1] Chemistry - A European Journal, 2011, vol. 17, # 20, p. 5652 - 5660
[2] Tetrahedron Letters, 2015, vol. 56, # 9, p. 1122 - 1123
[3] Synlett, 1998, # 2, p. 141 - 142
[4] Synlett, 2014, vol. 25, # 7, p. 995 - 1000
Spectrum DetailBack Directory
[Spectrum Detail]

1-Chloro-3-iodobenzene(625-99-0)MS
1-Chloro-3-iodobenzene(625-99-0)1HNMR
1-Chloro-3-iodobenzene(625-99-0)13CNMR
1-Chloro-3-iodobenzene(625-99-0)IR1
1-Chloro-3-iodobenzene(625-99-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Chloro-3-iodobenzene, 98%(625-99-0)
[Alfa Aesar]

1-Chloro-3-iodobenzene, 98%(625-99-0)
[Sigma Aldrich]

625-99-0(sigmaaldrich)
[TCI AMERICA]

3-Chloroiodobenzene  (stabilized with Copper chip),>97.0%(GC)(625-99-0)
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