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2,3-Difluorodibenzo-P-dioxin

HCID 39726
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Basic information

CAS
50585-38-1
Standard SMILES
Fc1cc2c(cc1F)Oc1ccccc1O2
InChIKey
ULFNOXMWCAHZMB-UHFFFAOYSA-N
Molecular formula
C12H6F2O2
Average molar mass
220.17 g/mol
Monoisotopic mass
220.03358575

Names & identifiers

Preferred name
2,3-Difluorodibenzo-P-dioxin
IUPAC
2,3-difluorodibenzo-p-dioxin
English name
2,3-Difluorodibenzo-p-dioxin
Molecular formula
C12H6F2O2
Molecular weight
220.17

Names & synonyms

2,3-DIFLUORODIBENZO-P-DIOXIN50585-38-12,3-difluorooxanthrene2,3-difluoro-dibenzo-p-dioxinDTXSID90198602DB-2603022,3-Difluorodibenzo[b,e][1,4]dioxinDibenzo[b,e][1,4]dioxin, 2,3-difluoro-

Database identifiers

CAS
50585-38-1
PubChem CID
39726
DTXSID
DTXSID90198602
Nikkaji
J89.565B

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
16
Formal charge
0
Complexity
235

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Related reactions

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Compound notes

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