Basic information
- CAS
39067-27-1- Standard SMILES
Cc1csc(-c2cccnc2)n1- InChIKey
MOUXQYCTQDNCAQ-UHFFFAOYSA-N- Molecular formula
- C9H8N2S
- Average molar mass
- 176.24 g/mol
Names & identifiers
- Preferred name
- 3-(4-Methyl-1,3-thiazol-2-yl)pyridine
- IUPAC
- 4-methyl-2-pyridin-3-yl-1,3-thiazole
Names & synonyms
3-(4-methyl-1,3-thiazol-2-yl)pyridine39067-27-1RefChem:493268852-030-63-(4-methylthiazol-2-yl)pyridine4-methyl-2-pyridin-3-yl-1,3-thiazoleMLS000698326SCHEMBL266591CHEMBL410355SCHEMBL1722906SCHEMBL3145458SCHEMBL11821369
Show more names
BDBM123674-methyl-2-(3-pyridyl)thiazoleMOUXQYCTQDNCAQ-UHFFFAOYSA-NHMS2515A143-(4-Methyl-2-thiazolyl)pyridinePBA067273-(4-methylthiazol-2-yl)-pyridineAKOS022226069
Database identifiers
- CAS
39067-27-1- PubChem CID
- 1201554
- ChEMBL
CHEMBL410355- EC Number
- 852-030-6
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
5 records
Compound notes
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