Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-

Base Information

• Chemical Name: Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-
• CAS No.: 73826-13-8
• Molecular Formula: C14H14F3NO3
• Molecular Weight: 301.26
• Nikkaji Number: J87.375F
• Mol file: 73826-13-8.mol

Synonyms:73826-13-8;3-((alpha-Methyl-m-trifluoromethylphenethyl)amidocarbonyl)propenoic acid;Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-;LS-123721;3-[[alpha-Methyl-m-(trifluoromethyl)phenethyl]carbamoyl]propenoic acid;2-Butenoic acid, 4-[[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-4-oxo-

Chemical Property of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-

Chemical Property:

• Vapor Pressure: 2.14E-09mmHg at 25°C
• Boiling Point: 463.7°C at 760 mmHg
• PKA: 3.54±0.10(Predicted)
• Flash Point: 234.2°C
• PSA: 69.89000
• Density: 1.293g/cm³
• LogP: 3.23370
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 301.09257779
• Heavy Atom Count: 21
• Complexity: 407

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)C=CC(=O)O
• Isomeric SMILES: CC(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)/C=C/C(=O)O

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