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Chloro-[2-(trichloromethyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]mercury

HCID 429028
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Basic information

CAS
51015-07-7
Standard SMILES
[Cl][Hg][CH]1CCCC2OC(C(Cl)(Cl)Cl)OC21
InChIKey
VQCTULQNQCVFHF-UHFFFAOYSA-M
Molecular formula
C8H10Cl4HgO2
Average molar mass
480.6 g/mol
Monoisotopic mass
479.914134

Names & identifiers

Preferred name
Chloro-[2-(trichloromethyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]mercury
IUPAC
chloro-[2-(trichloromethyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]mercury

Names & synonyms

51015-07-7NSC245505chloro-[2-(trichloromethyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]mercuryDTXSID00330339NSC-245505DS-011345Chlorido[2-(trichloromethyl)hexahydro-2H-1,3-benzodioxol-4-yl]mercuryMERCURY,CHLORO[HEXAHYDRO-2-(TRICHLOROMETHYL)-1,3-BENZODIOXOL-4-YL]-

Database identifiers

CAS
51015-07-7
PubChem CID
429028
DTXSID
DTXSID00330339

Properties

Computed structural properties

Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Formal charge
0
Complexity
235

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