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Home> Encyclopedia >Organic Intermediate>Pharmaceutical Intermediates>Organic Intermediates
1,4-DICHLORO-2-IODOBENZENE structure
3D Mol Similar
1,4-DICHLORO-2-IODOBENZENE structure

1,4-DICHLORO-2-IODOBENZENE
Iupac Name：1,4-dichloro-2-iodobenzene
CAS No.: 29682-41-5
Molecular Weight：272.89849
Modify Date.: 2022-11-22 18:57
Introduction:
1,4-DICHLORO-2-IODOBENZENE, with the chemical formula C6H3Cl2I and CAS registry number 29682-41-5, is a compound known for its applications in various chemical processes. This solid, also referred to as Dichloroiodobenzene, is characterized by its chlorine and iodine functional groups. It is commonly used as a reagent in organic synthesis, offering a versatile platform for the introduction of chlorine and iodine moieties into different molecules.
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1. Names and Identifiers
1.1 Name
1,4-DICHLORO-2-IODOBENZENE
1.2 Synonyms

1,4-Dichlor-2-jod-benzol 1,4-dichloro-2-iodo-benzene 1,4-dichloro-6-iodobenzene 1-Iodo-2,5-dichlorobenzene 2,5-Dichloro-1-iodobenzene 2,5-DICHLOROIODOBENZENE 2,5-dichloro-iodobenzene 2,5-Dichlorophenyl iodide 2-Iodo-1,4-dichlorobenzene 2-Iodo-p-dichlorobenzene Benzene, 1,4-dichloro-2-iodo- Benzene,1,4-dichloro-2-iodo EINECS 249-774-3 MFCD00001036

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1.3 CAS No.
29682-41-5
1.4 CID
122452
1.5 EINECS(EC#)
249-774-3
1.6 Molecular Formula
C6H3Cl2I (isomer)
1.7 Inchi
InChI=1S/C6H3Cl2I/c7-4-1-2-5(8)6(9)3-4/h1-3H
1.8 InChIkey
SBHVNORGKIPGCL-UHFFFAOYSA-N
1.9 Canonical Smiles
C1=CC(=C(C=C1Cl)I)Cl
1.10 Isomers Smiles
C1=CC(=C(C=C1Cl)I)Cl
2. Properties
2.1 Density
2.02
2.1 Melting point
21-257℃
2.1 Boiling point
255-256℃(742 torr)
2.1 Refractive index
n20/D 1.646(lit.)
2.1 Flash Point
93℃
2.1 Precise Quality
271.86600
2.1 PSA
0.00000
2.1 logP
3.59800
2.1 Appearance
COLORLESS TO GOLD LIQUID
2.2 Storage
Light Sensitive. Ambient temperatures.
2.3 Chemical Properties
Clear colourless tobrownishliquid 1,4-DICHLORO-2-IODOBENZENESupplier
2.4 StorageTemp
Keep in dark place,Sealed in dry,Room Temperature
3. Safety and Handling
3.1 Hazard Codes
Xi
3.1 Risk Statements
R36/37/38
3.1 Safety Statements
S24/25
3.1 Hazard Class
IRRITANT
3.1 Hazard Declaration
H315-H319-H335
3.1 RIDADR
NONH for all modes of transport
3.1 Caution Statement
P261-P305 + P351 + P338
3.1 WGK Germany
3
3.1 Sensitive
Light Sensitive
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation
Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P337+P313 If eye irritation persists: Get medical advice/attention.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

Storage

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

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8. Computational chemical data
  • Molecular Weight: 272.89849g/mol
  • Molecular Formula: C6H3Cl2I
  • Compound Is Canonicalized: True
  • XLogP3-AA: null
  • Exact Mass: 271.86565
  • Monoisotopic Mass: 271.86565
  • Complexity: 97.1
  • Rotatable Bond Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Topological Polar Surface Area: 0
  • Heavy Atom Count: 9
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
  • CACTVS Substructure Key Fingerprint: AAADcQBgAAAGAgAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGAIgAAAACAKCECAwAIAAAACAACBCAAACAAAgBQAIiAAAAogIICKBExCAIAAggAAIiAcAAAAAAAAQAAAAAAAAACAAAAAAAAAAAAAAAA==
9. Recommended Suppliers
Global47SuppliersView all >>
Dayang Chem (Hangzhou) Co., Ltd. Diamond member 13YRS Audited Suppliers China
  • Products:Chemical products
  • Tel:86-571-88938639
  • Email:sales-gc@dycnchem.com
1,4-Dichloro-2-Iodobenzene
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2024/06/17
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Jiaxing Isen Chemical Co.,Ltd Audited Suppliers Trading Company China
  • Products:Pharmaceutical intermediates
  • Tel:86-573-85280080
1,4-DICHLORO-2-IODOBENZENE
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2022/05/26
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Shijiazhuang Sdyano Fine Chemical Co., Ltd Audited Suppliers China
  • Products:Pharmaceutical Intermediates,Liquid Crystal Intermediates,Single Liquid Crystal,PDLC Liquid Crystal,OLED Organic Light Emitting Display.
  • Tel:86-311-80800737
1,4-DICHLORO-2-IODOBENZENE
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2019/04/01
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TCI (Shanghai) Development Co., Ltd. Audited Suppliers China
  • Tel:021-67121386 800-988-0390
1,4-Dichloro-2-iodobenzene
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2019/11/26
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Pure Chemistry Scientific Inc. Trading Company United States
  • Tel:+1-857-366-7588
1,4-Dichloro-2-iodobenzene
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 500 USD/gram
  • Time: 2019/02/25
Inquire
10. Realated Product Infomation
1,2-Dichloro-3-iodobenzene
2401-21-0 1,2-Dichloro-3-iodobenzene
1,3-DICHLORO-4-IODOBENZENE
29898-32-6 1,3-DICHLORO-4-IODOBENZENE
1,3-Dichloro-2-fluoro-5-iodobenzene
133307-08-1 1,3-Dichloro-2-fluoro-5-iodobenzene
1-BROMO-3,5-DICHLORO-2-IODOBENZENE
81067-44-9 1-BROMO-3,5-DICHLORO-2-IODOBENZENE
1-(benzyloxy)-2,4-dichloro-5-iodobenzene
847560-51-4 1-(benzyloxy)-2,4-dichloro-5-iodobenzene
1,2-Dichloro-5-difluoromethoxy-3-iodobenzene
1806328-67-5 1,2-Dichloro-5-difluoromethoxy-3-iodobenzene
1,2-Dichloro-3-difluoromethoxy-6-iodobenzene
1804516-73-1 1,2-Dichloro-3-difluoromethoxy-6-iodobenzene
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Directory
1. Names and Identifiers
2. Properties
2.1 Density
2.1 Melting point
2.1 Boiling point
2.1 Refractive index
2.1 Flash Point
2.1 Precise Quality
2.1 PSA
2.1 logP
2.1 Appearance
2.2 Storage
2.3 Chemical Properties
2.4 StorageTemp
3. Safety and Handling
3.1 Hazard Codes
3.1 Risk Statements
3.1 Safety Statements
3.1 Hazard Class
3.1 Hazard Declaration
3.1 RIDADR
3.1 Caution Statement
3.1 WGK Germany
3.1 Sensitive
4.MSDS
5.NMR Spectrum
6.Synthesis Route
7.Precursor and Product
8.Computational chemical data
9.Recommended Suppliers
 

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