1-Piperazinecarboxylic acid, 4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2)

Base Information

• Chemical Name: 1-Piperazinecarboxylic acid, 4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2)
• CAS No.: 65274-77-3
• Molecular Formula: C28H37F3N4O10
• Molecular Weight: 646.6094

Synonyms:65274-77-3;1-Piperazinecarboxylic acid, 4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2);C20H29F3N4O2.2C4H4O4;C20-H29-F3-N4-O2.2C4-H4-O4;LS-111005

Chemical Property of 1-Piperazinecarboxylic acid, 4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2)

Chemical Property:

• Vapor Pressure: 2.27E-09mmHg at 25°C
• Boiling Point: 479.9°C at 760 mmHg
• Flash Point: 244°C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 10
• Exact Mass: 646.24617788
• Heavy Atom Count: 45
• Complexity: 637

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Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)N1CCN(CC1)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCOC(=O)N1CCN(CC1)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

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