4-((2-Carboxy-3-(2-methoxyethoxy)propyl)-1-cyclopentanecarbonylamino)-1-cyclohexanecarboxylic acid

Base Information

• Chemical Name: 4-((2-Carboxy-3-(2-methoxyethoxy)propyl)-1-cyclopentanecarbonylamino)-1-cyclohexanecarboxylic acid
• CAS No.: 123898-42-0
• Molecular Formula: C20H33 N O7
• Molecular Weight: 399.47852
• DSSTox Substance ID: DTXSID80924634
• Mol file: 123898-42-0.mol

Synonyms:4-((2-carboxy-3-(2-methoxyethoxy)propyl)-1-cyclopentanecarbonylamino)-1-cyclohexanecarboxylic acid;candoxatrilat;candoxatrilat, 4(S)-cis isomer;U 73967;UK 69578;UK 73967;UK-69,578;UK-69578;UK-73,967;UK-73967

Chemical Property of 4-((2-Carboxy-3-(2-methoxyethoxy)propyl)-1-cyclopentanecarbonylamino)-1-cyclohexanecarboxylic acid

Chemical Property:

• Boiling Point: 642.1°Cat760mmHg
• Flash Point: 342.1°C
• PSA: 125.65000
• Density: 1.22g/cm³
• LogP: 2.90060
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 11
• Exact Mass: 399.22570239
• Heavy Atom Count: 28
• Complexity: 537

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCCOCC(CC1(CCCC1)C(=O)NC2CCC(CC2)C(=O)O)C(=O)O
• Uses: Antihypertensive.