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2,8-Dimethyldibenzo(c,g)(1,2,5,6)tetrathiocine

HCID 328849
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Basic information

CAS
66086-39-3
Standard SMILES
Cc1ccc2c(c1)SSc1ccc(C)cc1SS2
InChIKey
VSTYQQKTLXKBME-UHFFFAOYSA-N
Molecular formula
C14H12S4
Average molar mass
308.5 g/mol
Monoisotopic mass
307.98218508

Names & identifiers

Preferred name
2,8-Dimethyldibenzo(c,g)(1,2,5,6)tetrathiocine
IUPAC
2,8-dimethylbenzo[c][1,2,5,6]benzotetrathiocine

Names & synonyms

66086-39-32,8-Dimethyldibenzo(c,g)(1,2,5,6)tetrathiocineJ6361N7CZ4NSC 309466UNII-J6361N7CZ4NSC-309466DTXSID302162782,8-Dimethyldibenzo[c,g][1,2,5,6]tetrathiocine2,8-Dimethyldibenzo[c,g][1,2,5,6]tetrathiocin2,8-DIMETHYLDIBENZO(C,G)(1,2,5,6)TETRATHIOCINDIBENZO(C,G)(1,2,5,6)TETRATHIOCIN, 2,8-DIMETHYL-RefChem:83587
Show more names
DTXCID30138769NSC3094662,8-dimethylbenzo[c][1,2,5,6]benzotetrathiocineVSTYQQKTLXKBME-UHFFFAOYSA-N

Database identifiers

CAS
66086-39-3
PubChem CID
328849
DTXSID
DTXSID30216278
UNII
J6361N7CZ4

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
101 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
18
Formal charge
0
Complexity
255

Related reactions

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Compound notes

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