Basic information
- CAS
636-28-2- Standard SMILES
Brc1cc(Br)c(Br)cc1Br- InChIKey
QCKHVNQHBOGZER-UHFFFAOYSA-N- Molecular formula
- C6H2Br4
- Average molar mass
- 393.7 g/mol
- Monoisotopic mass
- 389.689
Overview
structure in first source
Names & identifiers
- Preferred name
- 1,2,4,5-Tetrabromobenzene
- IUPAC
- 1,2,4,5-tetrabromobenzene
- English name
- 1,2,4,5-Tetrabromobenzene
- Molecular formula
- C6H2Br4
- Molecular weight
- 393.7
Names & synonyms
1,2,4,5-TETRABROMOBENZENE636-28-2Benzene, 1,2,4,5-tetrabromo-1,2,4,5-tetraBBM25DK66LCZDTXSID7060910NSC-27002RefChem:71461DTXCID1044015211-253-32,3,5,6-TetrabromobenzeneMFCD00000063
Show more names
TETRABROMOBENZENEImidaprilat Impurity 91,2,4,5-TETRABROMOBENZEI,2,4,5-Tetrabrombenzol1,2,4,5-tetrabromo-benzenBenzene,1,2,4,5-tetrabromo-1,2,4,5-Tetrabromobenzene>
C6H2Br41,4,5-Tetrabromobenzene2,5,6-TetrabromobenzeneBenzene,2,4,5-tetrabromo-1,2,4,5-Tetrabromobenzene Solution in Toluene, 100ug/mLEINECS 211-253-3NSC 27002UNII-M25DK66LCZ
Database identifiers
- CAS
636-28-2- PubChem CID
- 12486
- DTXSID
DTXSID7060910- UNII
- M25DK66LCZ
- EC Number
- 211-253-3
- Nikkaji
- J2.098B
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 90.3
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP5.13
Physicochemical properties
- Melting point
- 180 · 180-182 °C (lit.)
- Boiling point
- 277.95 °C · 277.95°C (rough estimate)
- Density
- 3 · 3,072 g/cm3
- refractive index
- 1.6303 · 1.6303 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Soluble in alcohol, benzene, and ether (Weast, 1986)
- form
- Crystalline Powder, Crystals or Needles
- color
- Beige to brown
- Water Solubility
- Insoluble in water.
- BRN
- 1365830 · 1365830
- Henry's Law Constant
- 2.7 · 2.7×10-3 mol/(m3Pa) at 25℃, Kuramochi et al. (2004)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29039990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335-H413
- Hazard Classifications
- Aquatic Chronic 4Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P273-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,2,4,5-tetrabromo-: ACTIVE
Applications
Uses1,2,4,5-Tetrabromobenzene is a useful synthetic intermediate. It is used as a building block to prepare various aryl containing compounds such as tetrabenzanthracene, substituted pentacenes [pentacene (P237770)], n-stacking tetracene (N377650) derivatives and so on.
General DescriptionThe single structure of 1,2,4,5-tetrabromobenzene as actuating elements was studied and the relations between their mechanical properties and kinematic profile were determined.
Upstream & downstream products
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
温州共赢化学有限公司
Related reactions
1 records
Compound notes
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