6-Fluoro-8-nitro-1,2,3,4-tetrahydroquinolin-2-one
Basic information
- CAS
1310558-45-2- Standard SMILES
O=C1CCc2cc(F)cc([N+](=O)[O-])c2N1- InChIKey
JWAKJRPZAXKJKN-UHFFFAOYSA-N- Molecular formula
- C9H7FN2O3
- Average molar mass
- 210.16 g/mol
- Monoisotopic mass
- 210.04407025
Names & identifiers
- Preferred name
- 6-Fluoro-8-nitro-1,2,3,4-tetrahydroquinolin-2-one
- IUPAC
- 6-fluoro-8-nitro-3,4-dihydro-1H-quinolin-2-one
Names & synonyms
1310558-45-26-fluoro-8-nitro-1,2,3,4-tetrahydroquinolin-2-oneRefChem:543233895-967-66-fluoro-8-nitro-3,4-dihydroquinolin-2(1H)-one6-fluoro-8-nitro-3,4-dihydro-1H-quinolin-2-oneMFCD237037332(1H)-quinolinone, 6-fluoro-3,4-dihydro-8-nitro-6-fluoro-8-nitro-1,3,4-trihydroquinolin-2-oneSCHEMBL22868312SCHEMBL30163069JWAKJRPZAXKJKN-UHFFFAOYSA-N
Show more names
ALBB-024718SBB074385STL433303AKOS015998196LS-08164ST096342CS-0217348H34745
Database identifiers
- CAS
1310558-45-2- PubChem CID
- 51138330
- EC Number
- 895-967-6
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 292
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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