Basic information
- CAS
132667-24-4- Standard SMILES
O=c1[nH]c2cc(F)c([N+](=O)[O-])cc2o1- InChIKey
OYLSATYIXHNQKT-UHFFFAOYSA-N- Molecular formula
- C7H3FN2O4
- Average molar mass
- 198.11 g/mol
- Monoisotopic mass
- 198.00768474
Names & identifiers
- Preferred name
- 5-Fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one
- IUPAC
- 5-fluoro-6-nitro-3H-1,3-benzoxazol-2-one
Names & synonyms
5-fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one132667-24-4RefChem:535937995-636-75-FLUORO-6-NITRO-3H-1,3-BENZOXAZOL-2-ONE5-fluoro-6-nitro-2(3H)-benzoxazoloneSCHEMBL69709275-fluoro-6-nitro-benzooxazolinoneOYLSATYIXHNQKT-UHFFFAOYSA-N5-fluoro-6-nitro-benzoxazol-2-oneHFA667245-Fluoro-6-nitrobenzoxazolin-2-one
Show more names
AKOS026730115EN300-115158G59587
Database identifiers
- CAS
132667-24-4- PubChem CID
- 11217835
- EC Number
- 995-636-7
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 279
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Related reactions
7 records
Compound notes
Loading…