AC1MTIHC structure

AC1MTIHC

4-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one

Also Known As: CBMicro_036738|DivK1c_006034|CDS1_004994|NCGC00312907-01|BIM-0036615.P001|AB01308310-01|SR-01000533645-1|A2570/0109572|4-({4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol|4,4'-((4-((2-chlorobenzyl)oxy)-3-methoxyphenyl)methylene)bis(3-methyl-1H-pyrazol-5-ol)|4,4'-({4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}methanediyl)bis(3-methyl-1H-pyrazol-5-ol)|4,4'-({4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}methylene)bis(3-methyl-1H-pyrazol-5-ol)|4-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one

CAS: 680615-80-9
Molecular Formula C23H23ClN4O4
Molecular Weight 454.14078 g/mol
LogP 3.75744
Topological Polar Surface Area 115.76 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 454.14078
Monoisotopic Mass 454.14078
Heavy Atoms 32
Complexity 1310.5713

Chemical Identifiers

CAS Number 680615-80-9
SMILES CC1=C(C(=O)NN1)C(C2=CC(=C(C=C2)OCC3=CC=CC=C3Cl)OC)C4=C(NNC4=O)C

Product Overview

AC1MTIHC (CAS 680615-80-9), with molecular formula C23H23ClN4O4 and molecular weight 454.14078 g/mol. IUPAC: 4-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one.

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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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