1-Nitro-2-[2-(trifluoromethyl)phenoxy]benzene

HCID 20163311

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Basic information

CAS: 640766-74-1
Standard SMILES: O=[N+]([O-])c1ccccc1Oc1ccccc1C(F)(F)F
InChIKey: MIGOZRXDIFFEER-UHFFFAOYSA-N
Molecular formula: C13H8F3NO3
Average molar mass: 283.2 g/mol
Monoisotopic mass: 283.04562778

Names & identifiers

Preferred name: 1-Nitro-2-[2-(trifluoromethyl)phenoxy]benzene
IUPAC: 1-(2-nitrophenoxy)-2-(trifluoromethyl)benzene

Names & synonyms

1-Nitro-2-[2-(trifluoromethyl)phenoxy]benzene640766-74-1SCHEMBL1341293DTXSID706031832-[2-(trifluoromethyl)phenoxy]-1-nitrobenzene

Database identifiers

CAS: 640766-74-1
PubChem CID: 20163311
DTXSID: DTXSID70603183

Properties

Computed structural propertiesFilling in

XLogP: 4.2
Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 2
Heavy atoms: 20
Formal charge: 0
Complexity: 343

Related reactions

3 records

New reaction record

HRID 131808 reaction equation

HRID 131808As productuspto-grants-2008_06

HRID 559855 reaction equation

HRID 559855As productuspto-grants-2011_11

HRID 598940 reaction equation

HRID 598940As productuspto-grants-2011_03

Compound notes

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