Basic information
- CAS
166734-82-3- Standard SMILES
C=CCO[C@H](Cn1ccnc1)c1ccc(Cl)cc1Cl- InChIKey
PZBPKYOVPCNPJY-CQSZACIVSA-N- Molecular formula
- C14H14Cl2N2O
- Average molar mass
- 297.2 g/mol
- Monoisotopic mass
- 296.0483185
Overview
(S)-enilconazole is a 1-[2-(allyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole that is the (S)-enantiomer of enilconazole. It is an enantiomer of a (R)-enilconazole.
Names & identifiers
- Preferred name
- (S)-Enilconazole
- IUPAC
- 1-[(2S)-2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole
- English name
- (S)-enilconazole
- Molecular formula
- C14H14Cl2N2O
- Molecular weight
- 297.18
Names & synonyms
(S)-Enilconazole(S)-Imazalil166734-82-3Enilconazole, (+)-8C2D57DP4H(S)-1-(2-(ALLYLOXY)-2-(2,4-DICHLOROPHENYL)ETHYL)-1H-IMIDAZOLE1H-Imidazole, 1-((2S)-2-(2,4-dichlorophenyl)-2-(2-propen-1-yloxy)ethyl)-1H-Imidazole, 1-((2S)-2-(2,4-dichlorophenyl)-2-(2-propenyloxy)ethyl)-1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-(2-propenyloxy)ethyl)-, (S)-1-[(2S)-2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazoleUNII-8C2D57DP4H(+)-enilconazole
Show more names
Enilconazole Impurity 81H-Imidazole, 1-[(2S)-2-(2,4-dichlorophenyl)-2-(2-propen-1-yloxy)ethyl]-
(+)-imazalilENILCONAZOLE, (S)-SCHEMBL20472254CHEBI:83830DTXSID601317866PD132758Q271572641-[(2S)-2-(allyloxy)-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole
Database identifiers
- CAS
166734-82-3
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Boiling point
- 448.5 · 448.5±45.0 °C(Predicted)
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- 6.74 · 6.74±0.12(Predicted)
- FDA UNII
- 8 C2D57DP4H · 8C2D57DP4H
Chemistry & industry
Applications
Uses(S)-Imazalil is used as a fungicide for its enantioselective bioactivity, aquatic toxicity and dissipation in greenhouse vegetables and soil.
Suppliers2 total
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
Additional notes
DefinitionChEBI: (S)-enilconazole is a 1-[2-(allyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole that is the (S)-enantiomer of enilconazole It is an enantiomer of a (R)-enilconazole.
Related reactions
0 records
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Compound notes
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