3,3,5-Trimethyl-1-(2-oxo-2-((3-(trifluoromethyl)phenyl)amino)ethyl)cyclohexane-1-carboxylic acid

Name: 3,3,5-Trimethyl-1-(2-oxo-2-((3-(trifluoromethyl)phenyl)amino)ethyl)cyclohexane-1-carboxylic acid
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CAS No. 439096-52-3
Cat. No. CS-0575206
Molecule weight371.39
Purity≥98%
MDL No.None

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3,3,5-Trimethyl-1-(2-oxo-2-((3-(trifluoromethyl)phenyl)amino)ethyl)cyclohexane-1-carboxylic acid|CS-0575206

Structure of 439096-52-3

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General Information

CAS No. 439096-52-3
Cat. No. CS-0575206
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₉H₂₄F₃NO₃
Molecular Weight 371.39
Synonym(s) 3,3,5-trimethyl-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}cyclohexanecarboxylic acid
SMILES CC1CC(CC(C1)(CC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)O)(C)C

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 66.4
LogP 4.9512
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3,3,5-Trimethyl-1-(2-oxo-2-((3-(trifluoromethyl)phenyl)amino)ethyl)cyclohexane-1-carboxylic acid

CAS No. 439096-52-3

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