6-Methylimidazo(2,1-b)(1,3,4)thiadiazole
Basic information
- CAS
37654-77-6- Standard SMILES
Cc1cn2ncsc2n1- InChIKey
QMGBTAFRWOYLHS-UHFFFAOYSA-N- Molecular formula
- C5H5N3S
- Average molar mass
- 139.18 g/mol
- Monoisotopic mass
- 139.02041835
Names & identifiers
- Preferred name
- 6-Methylimidazo(2,1-b)(1,3,4)thiadiazole
- IUPAC
- 6-methylimidazo[2,1-b][1,3,4]thiadiazole
Names & synonyms
6-methylimidazo[2,1-b][1,3,4]thiadiazole37654-77-66-Methylimidazo(2,1-b)(1,3,4)thiadiazoleRefChem:543995848-044-7SCHEMBL2749931AKOS016363895DB-1973046-Methylimidazo[2,1-b]-1,3,4-thiadiazoleEN300-101635
Database identifiers
- CAS
37654-77-6- PubChem CID
- 4603076
- EC Number
- 848-044-7
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 119
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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