Basic information
- CAS
1375168-80-1- Standard SMILES
CN1CCC(Oc2cccc(F)c2)C1=O- InChIKey
JWLJWMCLUCDWSD-UHFFFAOYSA-N- Molecular formula
- C11H12FNO2
- Average molar mass
- 209.22 g/mol
- Monoisotopic mass
- 209.08520679
Names & identifiers
- Preferred name
- 3-(3-Fluorophenoxy)-1-methylpyrrolidin-2-one
- IUPAC
- 3-(3-fluorophenoxy)-1-methylpyrrolidin-2-one
Names & synonyms
3-(3-fluorophenoxy)-1-methylpyrrolidin-2-one1375168-80-1RefChem:492010103-828-1AFC16880AKOS013604577CS-0243210EN300-2608253-(3-fluorophenoxy)-1-methyl-pyrrolidin-2-oneZ1217960891
Database identifiers
- CAS
1375168-80-1- PubChem CID
- 64282982
- EC Number
- 103-828-1
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 247
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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