Benzene, 2-ethoxy-1-fluoro-3-nitro-
Basic information
- CAS
1233954-79-4- Standard SMILES
CCOc1c(F)cccc1[N+](=O)[O-]- InChIKey
FWCUZYLXWCEXQT-UHFFFAOYSA-N- Molecular formula
- C8H8FNO3
- Average molar mass
- 185.15 g/mol
- Monoisotopic mass
- 185.04882128
Names & identifiers
- Preferred name
- Benzene, 2-ethoxy-1-fluoro-3-nitro-
- IUPAC
- 2-ethoxy-1-fluoro-3-nitrobenzene
- English name
- 2-Ethoxy-1-fluoro-3-nitrobenzene
- Molecular formula
- C8H8FNO3
- Molecular weight
- 185.15
Names & synonyms
1233954-79-4Benzene, 2-ethoxy-1-fluoro-3-nitro-RefChem:3238962-Ethoxy-1-fluoro-3-nitrobenzeneMFCD17014041SCHEMBL22366682FWCUZYLXWCEXQT-UHFFFAOYSA-NDTXSID501294275AKOS026671655KS-54841-ETHOXY-2-FLUORO-6-NITROBENZENESY117801
Show more names
CS-0209164G73019F063582
Database identifiers
- CAS
1233954-79-4- PubChem CID
- 53255697
- DTXSID
DTXSID501294275
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 280.1 · 280.1±20.0 °C(Predicted)
- Density
- 1.268 · 1.268±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2909309090 · 2909309090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2909309090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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