Piperazinium, 1-(1,3-dithiol-2-ylidene)-4-methyl-, perchlorate

HCID 3064476

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Basic information

CAS: 104793-57-9
Standard SMILES: CN1CC[N+](=c2sccs2)CC1.[O-][Cl+3]([O-])([O-])[O-]
InChIKey: ZILHCXCHWKNESG-UHFFFAOYSA-M
Molecular formula: C8H13ClN2O4S2
Average molar mass: 300.8 g/mol
Monoisotopic mass: 300.0005269

Names & identifiers

Preferred name: Piperazinium, 1-(1,3-dithiol-2-ylidene)-4-methyl-, perchlorate
IUPAC: 1-(1,3-dithiol-2-ylidene)-4-methylpiperazin-1-ium perchlorate

Names & synonyms

1-(1,3-Dithiol-2-ylidene)-4-methylpiperazinium perchloratePiperazinium, 1-(1,3-dithiol-2-ylidene)-4-methyl-, perchlorate104793-57-9DTXSID50146740RefChem:372739DTXCID7069231SCHEMBL10518673ZILHCXCHWKNESG-UHFFFAOYSA-M1-(2H-1,3-Dithiol-2-ylidene)-4-methylpiperazin-1-ium perchlorate

Database identifiers

CAS: 104793-57-9
PubChem CID: 3064476
DTXSID: DTXSID50146740

Properties

Computed structural properties

Topological polar surface area: 131 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 0
Heavy atoms: 17
Formal charge: 0
Complexity: 311

Related reactions

1 records

New reaction record

HRID 648912As productuspto-grants-1988_04

Compound notes

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