Basic information
- CAS
39568-98-4- Standard SMILES
ClCc1c(Br)c(Br)c(CCl)c(Br)c1Br- InChIKey
ILZQVEFCITYZFF-UHFFFAOYSA-N- Molecular formula
- C8H4Br4Cl2
- Average molar mass
- 490.6 g/mol
- Monoisotopic mass
- 485.64236
Names & identifiers
- Preferred name
- 1,2,4,5-Tetrabromo-3,6-bis(chloromethyl)benzene
- IUPAC
- 1,2,4,5-tetrabromo-3,6-bis(chloromethyl)benzene
- English name
- 1,2,4,5-tetrabromo-3,6-bis(chloromethyl)benzene
- Molecular formula
- C8H4Br4Cl2
- Molecular weight
- 490.64
Names & synonyms
1,2,4,5-Tetrabromo-3,6-bis(chloromethyl)benzene39568-98-4EINECS 254-519-4X5P8J2T79TBenzene, 1,2,4,5-tetrabromo-3,6-bis(chloromethyl)-DTXSID301926842,3,5,6-TETRABROMO-.ALPHA.,.ALPHA.'-DICHLORO-P-XYLENERefChem:71460DTXCID701151752,3,5,6-TETRABROMO-ALPHA,ALPHA'-DICHLORO-P-XYLENE254-519-4UNII-X5P8J2T79T
Show more names
2,5-bis(chloromethyl)-1,3,4,6-tetrabromobenzene1,4-bis-(chloromethyl)-2,3,5,6-tetrabromobenzeneBenzene,1,2,4,5-tetrabromo-3,6-bis(chloromethyl)-SCHEMBL11146440ALBB-025885MFCD03208899SBB072731AKOS015998399
Database identifiers
- CAS
39568-98-4- PubChem CID
- 3016089
- DTXSID
DTXSID30192684- UNII
- X5P8J2T79T
- EC Number
- 254-519-4
- Nikkaji
- J261.387E
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- Boiling point
- 469.7 · 469.7±40.0 °C(Predicted)
- Density
- 2.341 · 2.341±0.06 g/cm3(Predicted)
- FDA UNII
- 5 P8J2T79T · X5P8J2T79T
Chemistry & industry
Suppliers2 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
2 records
Compound notes
Loading…