2-(2-((2-CL-Phenoxy)AC)carbohydrazonoyl)PH 3-CL-1-benzothiophene-2-carboxylate
Basic information
- CAS
477734-84-2- Standard SMILES
O=C(COc1ccccc1Cl)N/N=C/c1ccccc1OC(=O)c1sc2ccccc2c1Cl- InChIKey
QXWMGRQEEIMIQO-UVHMKAGCSA-N- Molecular formula
- C24H16Cl2N2O4S
- Average molar mass
- 499.4 g/mol
- Monoisotopic mass
- 498.0207836
Names & identifiers
- Preferred name
- 2-(2-((2-CL-Phenoxy)AC)carbohydrazonoyl)PH 3-CL-1-benzothiophene-2-carboxylate
- IUPAC
- [2-[(E)-[[2-(2-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate
- English name
- SALOR-INT L241946-1EA
- Molecular formula
- C24H16Cl2N2O4S
- Molecular weight
- 499.37
Names & synonyms
2-(2-((2-CL-PHENOXY)AC)CARBOHYDRAZONOYL)PH 3-CL-1-BENZOTHIOPHENE-2-CARBOXYLATERefChem:452301477734-84-2647-235-0AKOS024408635SALOR-INT L241946-1EABenzo[b]thiophene-2-carboxylic acid, 3-chloro-, 2-[[2-[2-(2-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl ester
Database identifiers
- CAS
477734-84-2- PubChem CID
- 9606526
- EC Number
- 647-235-0
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 712
Physicochemical properties
- Density
- 1.408 · 1.408±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.622 · 11.622±0.46(predicted)
- Hazard statements
- 413 · H413
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- Hazard statements
- H413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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