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Basic information
- CAS
32598-13-3- Standard SMILES
Clc1ccc(-c2ccc(Cl)c(Cl)c2)cc1Cl- InChIKey
UQMGJOKDKOLIDP-UHFFFAOYSA-N- Molecular formula
- C12H6Cl4
- Average molar mass
- 291.992 g/mol
- Monoisotopic mass
- 289.92236091
Names & identifiers
- Preferred name
- 3,3',4,4'-Tetrachlorobiphenyl
- IUPAC
- 3,3',4,4'-Tetrachloro-1,1'-biphenyl
- English name
- 3,3',4,4'-TETRACHLOROBIPHENYL
- Molecular formula
- C12H6Cl4
- Molecular weight
- 291.99
Names & synonyms
PCB-773,3',4,4'-Tetrachloro-1,1'-biphenylCB-77BZ-77TECB773344CB3344TCBBZ NO 77PCB NO 77Chebi:1367
Database identifiers
- CAS
32598-13-3、80333-65-9- PubChem CID
- 36187
- DTXSID
DTXSID5022514- ChEMBL
CHEMBL344161- ChEBI
CHEBI:1367- UNII
- Y2I6546TMI
- EC Number
- 634-804-3
- Nikkaji
- J70.045B
Properties
Physicochemical properties
- Melting point
- 182 · 182-184℃
- Boiling point
- 374.95 °C · 374.95°C (rough estimate)
- Density
- 1.442 · 1.4420 (rough estimate)
- refractive index
- 1.612 · 1.6120 (rough estimate)
- Flash point
- 100 °C · 100 °C
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Dichloromethane (Slightly)
- color
- Pale Grey
- Water Solubility
- 0.5489 ug/L · 0.5489ug/L(25 ºC)
- BRN
- 2051251 · 2051251
- Henry's Law Constant
- 1.2 · 1.2×10-2 mol/(m3Pa) at 25℃, Bhangare et al. (2019)
- InChIKey
- UQMGJOKDKOLIDP-UHFFFAOYSA-N
- EWG's Food Scores
- 6 · 6
- FDA UNII
- 2 I6546TMI · Y2I6546TMI
- EPA Substance Registry System
- 3 · 3,3',4,4'-Tetrachlorobiphenyl (32598-13-3)
- Symbol(GHS)
- 8 · GHS08,GHS09
- Signal word
- Warning
- Hazard statements
- 373 · H373-H410
- Precautionary statements
- 273 · P273-P314
- Hazard Codes
- N
- Risk Statements
- 33 · 33-50/53
- Safety Statements
- 35 · 35-60-61
- RIDADR
- 2315 · 2315
- WGK Germany
- 3 · 3
- RTECS
- 8650000 · DV8650000
- HazardClass
- 9 · 9
- PackingGroup
- II
- Hazardous Substances Data
- 32598 · 32598-13-3(Hazardous Substances Data)
Safety & regulation
Safety data
- wgk
- 3
- rtecs
- DV8650000
- ridadr
- 2315
- risk_code
- 33-50/53
- Signal word
- Warning
- Symbol(GHS)
- GHS08,GHS09
- hazard_code
- N
- safety_code
- 35-60-61
- hazard_class
- 9
- packing_group
- II
- Hazard statements
- H373-H410
- Precautionary statements
- P273-P314
- Hazardous Substances Data
- 32598-13-3(Hazardous Substances Data)
Chemistry & industry
Applications
Uses3,3'',4,4''-Tetrachlorobiphenyl is a polychlorinated biphenyl (PCB) congeners.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers3 total
Additional notes
DefinitionChEBI: A tetrachlorobiphenyl that is biphenyl in which the hydrogens at position 3 and 4 on each phenyl group are replaced by chlorines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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