4-Nitro-2-(trifluoromethyl)anisole

1-methoxy-4-nitro-2-(trifluoromethyl)benzene

CAS: 654-76-2

Molecular Formula	`C8H6F3NO3`
Molecular Weight	221.13 g/mol
LogP	2.6
Topological Polar Surface Area	55.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	1
Exact Mass	221.02998
Heavy Atoms	15
Complexity	238.0

Chemical Identifiers

CAS Number	654-76-2
SMILES	`COC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F`
InChIKey	`KGFADEJSZXEVMC-UHFFFAOYSA-N`

📖 Product Overview

4-Nitro-2-(trifluoromethyl)anisole (CAS: 654-76-2) is a chemical compound with molecular formula C8H6F3NO3 and molecular weight 221.13 g/mol. Its IUPAC systematic name is 1-methoxy-4-nitro-2-(trifluoromethyl)benzene. LogP 2.6 Topological Polar Surface Area 55.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 1 Exact Mass 221.02998 Heavy Atoms 15 Complexity 238.0 InChI Key: KGFADEJSZXEVMC-UHFFFAOYSA-N. SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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