Basic information
- CAS
5430-77-3- Standard SMILES
CN1CCN(C(=S)S)CC1- InChIKey
ZRNARZDEJVFNSK-UHFFFAOYSA-N- Molecular formula
- C6H12N2S2
- Average molar mass
- 176.3 g/mol
- Monoisotopic mass
- 176.04419074
Names & identifiers
- Preferred name
- 1-Piperazinecarbodithioic acid, 4-methyl-
- IUPAC
- 4-methylpiperazine-1-carbodithioic acid
Names & synonyms
5430-77-31-Piperazinecarbodithioic acid, 4-methyl-4-Methyl-1-piperazinecarbodithioic acidNSC 13411BRN 0119779DTXSID402026675-23-01-00112 (Beilstein Handbook Reference)RefChem:233419DTXCID701251584-methylpiperazine-1-carbodithioic acidNSC13411A9A95TJ9B3
Show more names
NSC-134111-Piperazinecarbodithioicacid,4-methyl-(6CI,8CI,9CI)UNII-A9A95TJ9B3SCHEMBL10917792SCHEMBL10917797AKOS0062730404-methyltetrahydro-1(2H)-pyrazinecarbodithioic acid
Database identifiers
- CAS
5430-77-3- PubChem CID
- 73167
- DTXSID
DTXSID40202667- UNII
- A9A95TJ9B3
- Nikkaji
- J1.595.332B
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 39.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 130
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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