Basic information
- CAS
54214-50-5- Standard SMILES
CN(N)C(=S)c1ccc(Cl)cc1- InChIKey
JRPUDQYDUGTQHN-UHFFFAOYSA-N- Molecular formula
- C8H9ClN2S
- Average molar mass
- 200.69 g/mol
- Monoisotopic mass
- 200.0174972
Names & identifiers
- Preferred name
- 4-chloro-N-methylbenzenecarbothiohydrazide
- IUPAC
- 4-chloro-N-methylbenzenecarbothiohydrazide
Names & synonyms
54214-50-5NSC142107DTXSID80969186NSC-1421074-Chloro-n-methyl-benzenecarbothiohydrazideDS-0053144-Chloro-N-methylbenzene-1-carbothiohydrazide
Database identifiers
- CAS
54214-50-5- PubChem CID
- 285274
- DTXSID
DTXSID80969186
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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