Basic information
- CAS
76584-71-9- Standard SMILES
Brc1cc(Br)c2c(c1)Oc1c(Br)cc(Br)cc1O2- InChIKey
FLEIILCTHUDZIV-UHFFFAOYSA-N- Molecular formula
- C12H4Br4O2
- Average molar mass
- 499.77 g/mol
- Monoisotopic mass
- 495.69448
Names & identifiers
- Preferred name
- 1,3,6,8-Tetrabromodibenzo-p-dioxin
- IUPAC
- 1,3,6,8-tetrabromodibenzo-p-dioxin
- English name
- 1,3,6,8-Tetrabromodibenzo[1,4]dioxin
- Molecular formula
- C12H4Br4O2
- Molecular weight
- 499.77
Names & synonyms
1,3,6,8-tetrabromooxanthrene1,3,6,8-Tetrabromodibenzo-p-dioxin76584-71-91,3,6,8-tetrabromo-dibenzo-dioxin62U837IAQ2UNII-62U837IAQ2Dibenzo(b,e)(1,4)dioxin, 1,3,6,8-tetrabromo-DTXSID3073638FLEIILCTHUDZIV-UHFFFAOYSA-NTETRABROMODIBENZO-P-DIOXIN, 1,3,6,8-Q272635151,3,6,8-Tetrabromodibenzo[1,4]dioxin
Show more names
1,3,6,8-Tetrabromodibenzo[b,e][1,4]dioxinDibenzo[b,e][1,4]dioxin, 1,3,6,8-tetrabromo-
Database identifiers
- CAS
76584-71-9- PubChem CID
- 93458
- DTXSID
DTXSID3073638- UNII
- 62U837IAQ2
- Nikkaji
- J373.777B
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- FDA UNII
- 62 U837IAQ2 · 62U837IAQ2
- EPA Substance Registry System
- 1 · 1,3,6,8-Tetrabromodibenzo-p-dioxin (76584-71-9)
Chemistry & industry
Suppliers1 total
QINGDAO KAIENSI INTERNATIONAL TRADE CO.,LTD.+86-0532-8699-9256 +86-18518128472 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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