(4-Amino-2,6-dichlorophenyl)(4-chlorophenyl)acetonitrile
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Basic information
- CAS
132252-58-5- Standard SMILES
N#CC(c1ccc(Cl)cc1)c1c(Cl)cc(N)cc1Cl- InChIKey
YVPUHAUYKMGZAY-UHFFFAOYSA-N- Molecular formula
- C14H9Cl3N2
- Average molar mass
- 311.6 g/mol
- Monoisotopic mass
- 309.983131
Names & identifiers
- Preferred name
- (4-Amino-2,6-dichlorophenyl)(4-chlorophenyl)acetonitrile
- IUPAC
- 2-(4-amino-2,6-dichlorophenyl)-2-(4-chlorophenyl)acetonitrile
- English name
- 4-AMino-2,6-dichloro-α-(4-chlorophenyl)benzeneacetonitrile
- Molecular formula
- C14H9Cl3N2
- Molecular weight
- 311.59
Names & synonyms
132252-58-5Diclazuril impurity E(4-Amino-2,6-dichlorophenyl)(4-chlorophenyl)acetonitrileUNII-9F90988RS59F90988RS5Diclazuril for veterinary use impurity E [EP](RS)-(4-Amino-2,6-dichlorophenyl)(4-chlorophenyl)acetonitrileDiclazuril for veterinary use specified impurity E [EP]DICLAZURIL FOR VETERINARY USE IMPURITY E [EP IMPURITY]Diclazuril impurity, 4-amino derivative-(USP)Diclazuril impurity, 4-amino derivative-[USP]DICLAZURIL FOR VETERINARY USE IMPURITY E (EP IMPURITY)
Show more names
4-Amino-2,6-dichloro-a-(4-chlorophenyl)benzeneacetonitrile4-Amino-2,6-dichloro-α-(4-chlorophenyl)benzeneacetonitrileBenzeneacetonitrile, 4-amino-2,6-dichloro-α-(4-chlorophenyl)-4-Amino-2,6-dichloro-α-(4-chlorophenyl)benzeneacetonitrile, CAS 132252-58-5
DICLAZURIL IMPURITY, 4-AMINO DERIVATIVE-(USP IMPURITY)DICLAZURIL IMPURITY, 4-AMINO DERIVATIVE-[USP IMPURITY]RefChem:69459Diclazuril for veterinary use impurity EDiclazuril for veterinary use specified impurity E(+-)-(4-AMINO-2,6-DICHLOROPHENYL)(4-CHLOROPHENYL)ACETONITRILE2-(4-amino-2,6-dichlorophenyl)-2-(4-chlorophenyl)acetonitrile4-amino-2,6-dichloro-alpha-(4-chlorophenyl)benzeneacetonitrile
Database identifiers
- CAS
132252-58-5- PubChem CID
- 15068435
- DTXSID
DTXSID901024927- UNII
- 9F90988RS5
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 334
Physicochemical properties
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- solid
- color
- Light yellow
- FDA UNII
- 9 F90988RS5 · 9F90988RS5
- HS Code
- 2926907090 · 2926907090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2926907090
Chemistry & industry
Applications
Uses4-AMino-2,6-dichloro-α-(4-chlorophenyl)benzeneacetonitrile is used in the synthesis of Diclazuril (D436200) and diclazuril derivatives.
Related reactions
3 records
Compound notes
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