[4,5-Diacetyloxy-6-(acetyloxymethyl)-2-methoxyoxan-3-yl]-phenylsulfanylmercury

HCID 416611

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Basic information

CAS: 4706-04-1
Standard SMILES: COC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)[CH]1[Hg][S]c1ccccc1
InChIKey: WYIFKHBGUBRJSX-UHFFFAOYSA-M
Molecular formula: C19H24HgO8S
Average molar mass: 613 g/mol
Monoisotopic mass: 614.089832

Names & identifiers

Preferred name: [4,5-Diacetyloxy-6-(acetyloxymethyl)-2-methoxyoxan-3-yl]-phenylsulfanylmercury
IUPAC: [4,5-diacetyloxy-6-(acetyloxymethyl)-2-methoxyoxan-3-yl]-phenylsulfanylmercury

Names & synonyms

4706-04-1NSC80210[4,5-diacetyloxy-6-(acetyloxymethyl)-2-methoxyoxan-3-yl]-phenylsulfanylmercuryDTXSID70329013NSC-80210Methyl 3,4,6-tri-O-acetyl(benzene)-2-deoxy-2-mercuryylhexopyranoside

Database identifiers

CAS: 4706-04-1
PubChem CID: 416611
DTXSID: DTXSID70329013

Properties

Computed structural properties

Topological polar surface area: 123 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 9
Rotatable bonds: 10
Heavy atoms: 29
Formal charge: 0
Complexity: 568

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