Basic information
- CAS
1176618-90-8- Standard SMILES
OCc1csc(-c2ccncc2)n1- InChIKey
HTBKSSGNHZFUDD-UHFFFAOYSA-N- Molecular formula
- C9H8N2OS
- Average molar mass
- 192.24 g/mol
- Monoisotopic mass
- 192.03573406
Names & identifiers
- Preferred name
- [2-(Pyridin-4-yl)-1,3-thiazol-4-yl]methanol
- IUPAC
- (2-pyridin-4-yl-1,3-thiazol-4-yl)methanol
Names & synonyms
[2-(pyridin-4-yl)-1,3-thiazol-4-yl]methanol1176618-90-8(2-(pyridin-4-yl)-1,3-thiazol-4-yl)methanolRefChem:395180818-118-3(2-(pyridin-4-yl)thiazol-4-yl)methanol(2-pyridin-4-yl-1,3-thiazol-4-yl)methanolSCHEMBL15349110HTBKSSGNHZFUDD-UHFFFAOYSA-NBXB61890[2-(4-pyridyl)thiazol-4-yl]methanolAKOS014315951
Show more names
DB-344526CS-0235774EN300-1608755Z1255451279
Database identifiers
- CAS
1176618-90-8- PubChem CID
- 39238577
- EC Number
- 818-118-3
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
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)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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