AC1MX3DQ structure

AC1MX3DQ

[3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]-thiophen-2-ylmethanone

Also Known As: Bionet1_004266|HMS581B08|KS-000031FS|(3-{1-[(2-fluoro[1,1'-biphenyl]-4-yl)oxy]ethyl}-1H-pyrazol-1-yl)(2-thienyl)methanone|12P-071|[3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]-thiophen-2-ylmethanone|3-[1-({2-fluoro-[1,1'-biphenyl]-4-yl}oxy)ethyl]-1-(thiophene-2-carbonyl)-1H-pyrazole

CAS: 477709-67-4
Molecular Formula C22H17FN2O2S
Molecular Weight 392.0995 g/mol
LogP 5.5792
Topological Polar Surface Area 44.12 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 392.0995
Monoisotopic Mass 392.0995
Heavy Atoms 28
Complexity 1090.9493

Chemical Identifiers

CAS Number 477709-67-4
SMILES CC(C1=NN(C=C1)C(=O)C2=CC=CS2)OC3=CC(=C(C=C3)C4=CC=CC=C4)F

Product Overview

AC1MX3DQ (CAS 477709-67-4), with molecular formula C22H17FN2O2S and molecular weight 392.0995 g/mol. IUPAC: [3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]-thiophen-2-ylmethanone.

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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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