Basic information
- Standard SMILES
Clc1ccccc1Nc1nnns1- InChIKey
QYAMUHDLDMHXMB-UHFFFAOYSA-N- Molecular formula
- C7H5ClN4S
- Average molar mass
- 212.66 g/mol
- Monoisotopic mass
- 211.99234484
Names & identifiers
- Preferred name
- N-(2-Chlorophenyl)-1,2,3,4-thiatriazol-5-amine
- IUPAC
- N-(2-chlorophenyl)thiatriazol-5-amine
Names & synonyms
N-(2-Chlorophenyl)-1,2,3,4-thiatriazol-5-amine70974-27-5RefChem:360604DTXSID901247707
Database identifiers
- CAS
70974-27-5- PubChem CID
- 12904014
- DTXSID
DTXSID901247707
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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