6,8-Bis[(dimethylarsino)thio]octanoic acid

HCID 323072

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Basic information

CAS: 69819-89-2
Standard SMILES: C[As](C)SCCC(CCCCC(=O)O)S[As](C)C
InChIKey: NGCGKCFBKQWNRI-UHFFFAOYSA-N
Molecular formula: C12H26As2O2S2
Average molar mass: 416.3 g/mol
Monoisotopic mass: 415.98061

Names & identifiers

Preferred name: 6,8-Bis[(dimethylarsino)thio]octanoic acid
IUPAC: 6,8-bis(dimethylarsanylsulfanyl)octanoic acid

Names & synonyms

NSC28180469819-89-26,8-Bis[(dimethylarsino)thio]octanoic acidDTXSID201333969NSC-2818046,8-Bis[(dimethylarsanyl)sulfanyl]octanoic acidOctanoic acid,8-bis[(dimethylarsino)thio]-, (.+-.)-(.+-.)-6,8-BIS[(DIMETHYLARSINO)THIO]OCTANOIC ACID

Database identifiers

CAS: 69819-89-2
PubChem CID: 323072
DTXSID: DTXSID201333969

Properties

Computed structural properties

Topological polar surface area: 87.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 11
Heavy atoms: 18
Formal charge: 0
Complexity: 226

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