Basic information
- CAS
50878-38-1- Standard SMILES
CSC(=S)NNc1ccccc1- InChIKey
SZCVCDOFDCMDRN-UHFFFAOYSA-N- Molecular formula
- C8H10N2S2
- Average molar mass
- 198.3 g/mol
- Monoisotopic mass
- 198.02854067
Names & identifiers
- Preferred name
- Hydrazinecarbodithioic acid, 2-phenyl-, methyl ester
- IUPAC
- methyl N-anilinocarbamodithioate
- English name
- 3-Phenyldithiocarbazic acid methyl ester
- Molecular formula
- C8H10N2S2
- Molecular weight
- 198.31
Names & synonyms
50878-38-13-Phenyldithiocarbazic acid methyl esterHydrazinecarbodithioic acid, 2-phenyl-, methyl estermethyl 3-phenyldithiocarbazateSCHEMBL31311171DTXSID70965112SZCVCDOFDCMDRN-UHFFFAOYSA-NMethyl 2-phenylhydrazinecarbodithioate #DB-228739Methyl hydrogen phenylcarbonodithiohydrazonate2-Phenylhydrazinedithiocarboxylic acid methyl ester
Database identifiers
- CAS
50878-38-1- PubChem CID
- 3036367
- DTXSID
DTXSID70965112- Nikkaji
- J117.417G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 81.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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