Basic information
- CAS
299934-10-4- Standard SMILES
Nc1nnc(-c2ccccc2I)s1- InChIKey
KSLRKHNUTZIYLE-UHFFFAOYSA-N- Molecular formula
- C8H6IN3S
- Average molar mass
- 303.13 g/mol
Names & identifiers
- Preferred name
- 5-(2-Iodophenyl)-1,3,4-thiadiazol-2-amine
- IUPAC
- 5-(2-iodophenyl)-1,3,4-thiadiazol-2-amine
- English name
- 5-(2-Iodo-phenyl)-[1,3,4]thiadiazol-2-ylamine
- Molecular formula
- C8H6IN3S
- Molecular weight
- 303.12
Names & synonyms
5-(2-Iodophenyl)-1,3,4-thiadiazol-2-amine299934-10-4Cambridge id 5538066SCHEMBL28353369KSLRKHNUTZIYLE-UHFFFAOYSA-NSTK041352AKOS000225265CS-0323733EU-0035054ST503375701,3,4-Thiadiazol-2-amine, 5-(2-iodophenyl)-5-(2-Iodophenyl)-1,3,4-thiadiazol-2-amine #
Show more names
VITAS-BB TBB0000125-(2-Iodo-phenyl)-[1,3,4]thiadiazol-2-ylamine
5-(2-iodophenyl)-1,3,4-thiadiazole-2-ylamineSR-01000402370SR-01000402370-1
Database identifiers
- CAS
299934-10-4
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Boiling point
- 427.9 · 427.9±47.0 °C(Predicted)
- Density
- 1.955 · 1.955±0.06 g/cm3(Predicted)
- pka
- 2.28 · 2.28±0.10(Predicted)
Chemistry & industry
Suppliers2 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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