HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2,3-Dibromo-7,8-difluorodibenzo-p-dioxin

HCID 39731
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
50585-43-8
Standard SMILES
Fc1cc2c(cc1F)Oc1cc(Br)c(Br)cc1O2
InChIKey
OYZFZUIMCOBMIR-UHFFFAOYSA-N
Molecular formula
C12H4Br2F2O2
Average molar mass
377.96 g/mol
Monoisotopic mass
375.85461

Names & identifiers

Preferred name
2,3-Dibromo-7,8-difluorodibenzo-p-dioxin
IUPAC
2,3-dibromo-7,8-difluorodibenzo-p-dioxin
English name
2,3-Dibromo-7,8-difluorodibenzo-p-dioxin
Molecular formula
C12H4Br2F2O2
Molecular weight
377.96

Names & synonyms

2,3-DIBROMO-7,8-DIFLUORODIBENZO-P-DIOXIN50585-43-8DTXSID70198605RefChem:81562DTXCID901210962,3-dibromo-7,8-difluorooxanthreneDB-2602892,3-Dibromo-7,8-difluorodibenzo[b,e][1,4]dioxinDibenzo[b,e][1,4]dioxin, 2,3-dibromo-7,8-difluoro-

Database identifiers

CAS
50585-43-8
PubChem CID
39731
DTXSID
DTXSID70198605
Nikkaji
J89.568G

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
18
Formal charge
0
Complexity
290

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes