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Tetrachloroethylene oxide

HCID 27973
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Basic information

CAS
16650-10-5
Standard SMILES
ClC1(Cl)OC1(Cl)Cl
InChIKey
PHEPAUSSNBXGQO-UHFFFAOYSA-N
Molecular formula
C2Cl4O
Average molar mass
181.8 g/mol
Monoisotopic mass
179.870325

Names & identifiers

Preferred name
Tetrachloroethylene oxide
IUPAC
2,2,3,3-tetrachlorooxirane
English name
tetrachloroepoxyethane
Molecular formula
C2Cl4O
Molecular weight
181.83

Names & synonyms

TetrachlorooxiraneTETRACHLOROETHYLENE OXIDE2,2,3,3-tetrachlorooxirane16650-10-52PJ36AO63QTetrachloroepoxyethanePCEOEpoxyperchlorovinylOxirane, tetrachloro-Ethane, tetrachloroepoxy-BRN 0104771UNII-2PJ36AO63Q
Show more names
1,2-EpoxytetrachloroethaneOxirane, 2,2,3,3-tetrachloro-
tetrachloroxirane5-17-01-00009 (Beilstein Handbook Reference)SCHEMBL5945078DTXSID60168115AKOS006277380Q27255418

Database identifiers

CAS
16650-10-5
PubChem CID
27973
DTXSID
DTXSID60168115
UNII
2PJ36AO63Q
Nikkaji
J78.120G

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Formal charge
0
Complexity
85.9

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Boiling point
111.17 °C · 111.17°C (rough estimate)
Density
1.7219 · 1.7219 (estimate)
FDA UNII
2 PJ36AO63Q · 2PJ36AO63Q

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