(trans,trans)-3,4,5-Trifluorophenyl 4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate

Base Information

• Chemical Name: (trans,trans)-3,4,5-Trifluorophenyl 4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate
• CAS No.: 181943-55-5
• Molecular Formula: C21H27 F3 O2
• Molecular Weight: 368.43
• European Community (EC) Number: 605-953-1
• DSSTox Substance ID: DTXSID30705233
• Nikkaji Number: J2.565.738A
• Mol file: 181943-55-5.mol

Synonyms:181943-55-5;(trans,trans)-3,4,5-Trifluorophenyl 4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate;(3,4,5-trifluorophenyl) 4-(4-ethylcyclohexyl)cyclohexane-1-carboxylate;[1,1'-Bicyclohexyl]-4-carboxylic acid, 4'-ethyl-, 3,4,5-trifluorophenyl ester, (trans,trans)-;3,4,5-Trifluorophenyl 4'-ethyl[1,1'-bi(cyclohexane)]-4-carboxylate;TRANS,TRANS-3,4,5-TRIFLUOROPHENYL 4/'/'-ETHYLBICYCLOHEXYL-4-CARBOXYLATE;TRANS,TRANS-3,4,5-TRIFLUOROPHENYL 4'-ETHYLBICYCLOHEXYL-4-CARBOXYLATE;SCHEMBL14274428;SCHEMBL16258073;DTXSID30705233;JRVLFALUMBSZRJ-UHFFFAOYSA-N;AKOS025287073;(trans,trans)-3,4,5-Trifluorophenyl4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate;(1alpha)-4beta-[(1alpha)-4beta-Ethylcyclohexyl]cyclohexanecarboxylic acid 3,4,5-trifluorophenyl ester;3,4,5-TRIFLUOROPHENYL (1R,1'S,4R,4'R)-4'-ETHYL-[1,1'-BI(CYCLOHEXANE)]-4-CARBOXYLATE

Chemical Property of (trans,trans)-3,4,5-Trifluorophenyl 4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate

Chemical Property:

• Boiling Point: 425.5±45.0 °C(Predicted)
• PSA: 26.30000
• Density: 1.151±0.06 g/cm3(Predicted)
• LogP: 6.03210
• XLogP3: 7.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 368.19631459
• Heavy Atom Count: 26
• Complexity: 444

Purity/Quality:

95% ^*data from raw suppliers

TRANS,TRANS-3,4,5-TRIFLUOROPHENYL-4'-ETHYLBICYCLOHEXYL-4-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC(=C(C(=C3)F)F)F