AC1O6PIT
2-[2-chloro-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]acetic acid
Also Known As: AH-487/15276092|AB00108510-01|SR-01000235334-1|{2-chloro-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid|2-[2-chloro-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]acetic acid|(E)-2-(2-chloro-4-((3-methyl-5-oxo-1-phenyl-1H-pyrazol-4(5H)-ylidene)methyl)phenoxy)acetic acid|{2-chloro-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid
| Molecular Formula | C19H15ClN2O4 |
|---|---|
| Molecular Weight | 370.07202 g/mol |
| LogP | 3.6095 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.07202 |
| Monoisotopic Mass | 370.07202 |
| Heavy Atoms | 26 |
| Complexity | 922.3913 |
Chemical Identifiers
| CAS Number | 428475-40-5 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OCC(=O)O)Cl)C3=CC=CC=C3 |
Product Overview
AC1O6PIT (CAS 428475-40-5), with molecular formula C19H15ClN2O4 and molecular weight 370.07202 g/mol. IUPAC: 2-[2-chloro-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]acetic acid.
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