Piperazine 1,3,4,5-tetrahydroxycyclohexane-1-carboxylate

Base Information

• Chemical Name: Piperazine 1,3,4,5-tetrahydroxycyclohexane-1-carboxylate
• CAS No.: 59766-07-3
• Molecular Formula: C11H22N2O6
• Molecular Weight: 278.30218
• European Community (EC) Number: 261-918-7
• DSSTox Substance ID: DTXSID10975174
• Mol file: 59766-07-3.mol

Synonyms:59766-07-3;EINECS 261-918-7;DTXSID10975174;1,3,4,5-Tetrahydroxycyclohexane-1-carboxylic acid--piperazine (1/1)

Chemical Property of Piperazine 1,3,4,5-tetrahydroxycyclohexane-1-carboxylate

Chemical Property:

• Vapor Pressure: 1.58E-09mmHg at 25°C
• Boiling Point: 438.4°C at 760 mmHg
• Flash Point: 233.1°C
• PSA: 142.28000
• LogP: -2.48460
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 278.14778643
• Heavy Atom Count: 19
• Complexity: 230

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCN1.C1C(C(C(CC1(C(=O)O)O)O)O)O
• Isomeric SMILES: C1CNCCN1.C1[C@@H](C([C@H](CC1(C(=O)O)O)O)O)O

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