2-(Pyridin-2-yl)-1,3-thiazole-4-carbaldehyde
Basic information
- CAS
173838-60-3- Standard SMILES
O=Cc1csc(-c2ccccn2)n1- InChIKey
NPVUCLKAKKBRFA-UHFFFAOYSA-N- Molecular formula
- C9H6N2OS
- Average molar mass
- 190.22 g/mol
- Monoisotopic mass
- 190.02008399
Names & identifiers
- Preferred name
- 2-(Pyridin-2-yl)-1,3-thiazole-4-carbaldehyde
- IUPAC
- 2-pyridin-2-yl-1,3-thiazole-4-carbaldehyde
- English name
- 4-Thiazolecarboxaldehyde, 2-(2-pyridinyl)-
- Molecular formula
- C9H6N2OS
- Molecular weight
- 190.22
Names & synonyms
2-(pyridin-2-yl)-1,3-thiazole-4-carbaldehydeRefChem:462078842-011-0173838-60-34-Thiazolecarboxaldehyde, 2-(2-pyridinyl)-2-(pyridin-2-yl)thiazole-4-carbaldehyde2-pyridin-2-yl-1,3-thiazole-4-carbaldehydeMFCD06340092SCHEMBL24382562-(2-pyridyl)-4-formylthiazoleDTXSID10366649NPVUCLKAKKBRFA-UHFFFAOYSA-N
Show more names
YGA838602-(2-Pyridyl)thiazole-4-carbaldehydeAKOS0089676912-pyridin-2-yl-thiazole-4-carbaldehydeSY1784012-(2-pyridinyl)-4-thiazole-carboxaldehydeDB-329484CS-0248497
Database identifiers
- CAS
173838-60-3- PubChem CID
- 2125337
- DTXSID
DTXSID10366649- EC Number
- 842-011-0
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Boiling point
- 386.2 · 386.2±40.0 °C(Predicted)
- Density
- 1.336 · 1.336±0.06 g/cm3(Predicted)
- pka
- 0.42 · 0.42±0.19(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H302-H319-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H302-H319-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
3 records
Compound notes
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