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1-methyl-5-(methyldithio)-1H-tetrazole

HCID 124585
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
101554-56-7
Standard SMILES
CSSc1nnnn1C
InChIKey
IUZIEKCFCJWFTM-UHFFFAOYSA-N
Molecular formula
C3H6N4S2
Average molar mass
162.2 g/mol
Monoisotopic mass
162.00338856

Names & identifiers

Preferred name
1-methyl-5-(methyldithio)-1H-tetrazole
IUPAC
1-methyl-5-(methyldisulfanyl)tetrazole
English name
1-methyl-5-(methyldithio)-1H-tetrazole
Molecular formula
C3H6N4S2
Molecular weight
162.24

Names & synonyms

1-Methyl-5-(methyldithio)-1H-tetrazole101554-56-71-MmtsMethyl 1-methyltetrazol-5-yl disulfideDTXSID90143995RefChem:76339DTXCID20664861-methyl-5-(methyldisulfanyl)tetrazole1H-Tetrazole, 1-methyl-5-(methyldithio)-1-Methyl-5-(methyldisulfanyl)-1H-tetrazole

Database identifiers

CAS
101554-56-7
PubChem CID
124585
DTXSID
DTXSID90143995

Properties

Computed structural propertiesFilling in

XLogP
0.4
Topological polar surface area
94.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
9
Formal charge
0
Complexity
89.9

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