6-Ethyl-2-((3-fluorobenzyl)thio)-5-methyl-4-(trifluoromethyl)nicotinonitrile

Name: 6-Ethyl-2-((3-fluorobenzyl)thio)-5-methyl-4-(trifluoromethyl)nicotinonitrile
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CAS No. 664994-27-8
Cat. No. CS-0574605
Purity≥98%
MDL No.None

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6-Ethyl-2-((3-fluorobenzyl)thio)-5-methyl-4-(trifluoromethyl)nicotinonitrile|CS-0574605

Structure of 664994-27-8

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General Information

CAS No. 664994-27-8
Cat. No. CS-0574605
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₇H₁₄F₄N₂S
Molecular Weight 354.37
Synonym(s) 6-ethyl-2-[(3-fluorobenzyl)sulfanyl]-5-methyl-4-(trifluoromethyl)nicotinonitrile
SMILES N#CC1=C(SCC2=CC=CC(F)=C2)N=C(CC)C(C)=C1C(F)(F)F

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 36.68
LogP 5.2743
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Thioether

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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6-Ethyl-2-((3-fluorobenzyl)thio)-5-methyl-4-(trifluoromethyl)nicotinonitrile

CAS No. 664994-27-8

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