Fenridazon

HCID 197225
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Basic information

CAS
68254-10-4
Standard SMILES
Cc1cc(=O)c(C(=O)O)nn1-c1ccc(Cl)cc1
InChIKey
JDEKUYKSOCTBJT-UHFFFAOYSA-N
Molecular formula
C12H9ClN2O3
Average molar mass
264.66 g/mol
Monoisotopic mass
264.03016983

Names & identifiers

Preferred name
Fenridazon
IUPAC
1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carboxylic acid
English name
1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxylate
Molecular formula
C12H9ClN2O3
Molecular weight
264.66

Names & synonyms

Fenridazon68254-10-4Fenridazon [ISO]UNII-Q6E8BE2U25Q6E8BE2U25DTXSID40581581-(4-CHLOROPHENYL)-1,4-DIHYDRO-6-METHYL-4-OXO-3-PYRIDAZINECARBOXYLIC ACID1-(4-CHLOROPHENYL)-1,4-DIHYDRO-6-METHYL-4-OXOPYRIDAZINE-3-CARBOXYLIC ACIDRefChem:140206DTXCID00319261-(4-chlorophenyl)-6-methyl-4-oxo-1,4-dihydropyridazine-3-carboxylic acid1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carboxylic acid
Show more names
Butafenacil Impurity 81-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxylate1-(4-chlorophenyl)-6-Methyl-4-oxo-1,4-dihydropyridazine-3-carboxylate3-Pyridazinecarboxylic acid, 1-(4-chlorophenyl)-1,4-dihydro-6-methyl-4-oxo-
MLS000773803SCHEMBL122207CHEMBL1886197JDEKUYKSOCTBJT-UHFFFAOYSA-NHMS2769O171-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxylic AcidMSK24085MFCD00833911

Database identifiers

CAS
68254-10-4
PubChem CID
197225
DTXSID
DTXSID4058158
ChEMBL
CHEMBL1886197
UNII
Q6E8BE2U25
Nikkaji
J3.183.949A

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
70 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
18

Experimental & physicochemical properties

Pesticides · 2 items

Plant Growth Regulators

Active substance -> EU Pesticides database: Not approved

Solubility>39.7 [ug/mL] (The mean of the results at pH 7.4)

Physicochemical properties

Melting point
234.3 · 234.3-235.1℃ (ethanol )
Boiling point
453.4 · 453.4±47.0 °C(Predicted)
Density
1.43 · 1.43±0.1 g/cm3(Predicted)
pka
0.17 · 0.17±0.20(Predicted)
FDA UNII
6 E8BE2U25 · Q6E8BE2U25

Safety & regulation

Hazard information

Regulatory Information2002/2076

Chemistry & industry

Suppliers6 total

西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]

Related reactions

15 records
New reaction record

Compound notes

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