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

Base Information

• Chemical Name: 1-Piperazinecarboxylic acid, 4-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2)
• CAS No.: 65274-79-5
• Molecular Formula: C27H37ClN4O10
• Molecular Weight: 496.99

Synonyms:1-Piperazinecarboxylic acid, 4-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2);65274-79-5;C19H29ClN4O2.2C4H4O4;C19-H29-Cl-N4-O2.2C4-H4-O4;LS-110856

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

Chemical Property:

• Vapor Pressure: 4.57E-10mmHg at 25°C
• Boiling Point: 498.3°C at 760 mmHg
• Flash Point: 255.2°C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 10
• Exact Mass: 612.2198211
• Heavy Atom Count: 42
• Complexity: 556

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MSDS Files:

Useful:

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

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