Basic information
- CAS
889939-04-2- Standard SMILES
CC(=O)c1cc(-c2cccnc2)no1- InChIKey
KDWLANIMFVYTQF-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2
- Average molar mass
- 188.18 g/mol
- Monoisotopic mass
- 188.0585775
Names & identifiers
- Preferred name
- 1-(3-(Pyridin-3-yl)-1,2-oxazol-5-yl)ethan-1-one
- IUPAC
- 1-(3-pyridin-3-yl-1,2-oxazol-5-yl)ethanone
- English name
- 5-ACETYL-3(3-PYRIDYL)-ISOXAZOLE
- Molecular formula
- C10H8N2O2
- Molecular weight
- 188.18
Names & synonyms
889939-04-21-[3-(Pyridin-3-yl)-1,2-oxazol-5-yl]ethan-1-oneDTXSID806285491-(3-(Pyridin-3-yl)-1,2-oxazol-5-yl)ethan-1-oneRefChem:224151DTXCID00579302854-136-85-Acetyl-3(3-pyridyl)isoxazoleEthanone,1-[3-(3-pyridinyl)-5-isoxazolyl]-1-(3-(Pyridin-3-yl)isoxazol-5-yl)ethanone1-(3-pyridin-3-yl-1,2-oxazol-5-yl)ethanoneSCHEMBL23930645
Show more names
5-ACETYL-3(3-PYRIDYL)-ISOXAZOLE
5-Acetyl-3-(3-pyridyl)isoxazolePKB93904AKOS006290648CS-0263251EN300-8578037A1-04756
Database identifiers
- CAS
889939-04-2- PubChem CID
- 22831981
- DTXSID
DTXSID80628549- EC Number
- 854-136-8
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · 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
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers4 total
Carbone Scientific CO., LTD[email protected]
CIVENTICHEM[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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