3-Methyl-2-(5-trifluoromethyl-pyridin-2-ylamino)-butyric acid

Base Information

• Chemical Name: 3-Methyl-2-(5-trifluoromethyl-pyridin-2-ylamino)-butyric acid
• CAS No.: 1028251-32-2
• Molecular Formula: C11H13F3N2O2
• Molecular Weight: 262.23
• DSSTox Substance ID: DTXSID20389288
• Mol file: 1028251-32-2.mol

Synonyms:1028251-32-2;3-Methyl-2-(5-trifluoromethyl-pyridin-2-ylamino)-butyric acid;N-[5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]VALINE;3-methyl-2-[[5-(trifluoromethyl)pyridin-2-yl]amino]butanoic acid;(S)-3-Methyl-2-((5-(trifluoromethyl)pyridin-2-yl)amino)butanoic acid;SCHEMBL3049728;DTXSID20389288;BCFIHQUDURXWQA-UHFFFAOYSA-N;HMS1683I10;MFCD01076937;AKOS000301505;AKOS017268649;FT-0677175;SR-01000318621;SR-01000318621-1;N-[5-(trifluoromethyl)pyridin-2-yl]valine, AldrichCPR;3-Methyl-2-(5-(trifluoromethyl)pyridin-2-ylamino)butanoic acid;(2R)-3-methyl-2-{[5-(trifluoromethyl)-2-pyridinyl]amino}butanoic acid

Chemical Property of 3-Methyl-2-(5-trifluoromethyl-pyridin-2-ylamino)-butyric acid

Chemical Property:

• Boiling Point: 381.7±42.0 °C(Predicted)
• PKA: 3.38±0.10(Predicted)
• PSA: 62.22000
• Density: 1.330±0.06 g/cm3(Predicted)
• LogP: 2.69450
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 262.09291215
• Heavy Atom Count: 18
• Complexity: 295

Purity/Quality:

98% ^*data from raw suppliers

N-[5-(Trifluoromethyl)pyridin-2-yl]valine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)O)NC1=NC=C(C=C1)C(F)(F)F