Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate)

Base Information

• Chemical Name: Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate)
• CAS No.: 5793-87-3
• Molecular Formula: C7H12 O6 . 1/2 Ca
• Molecular Weight: 422.39528
• European Community (EC) Number: 227-333-6
• DSSTox Substance ID: DTXSID40973507
• Mol file: 5793-87-3.mol

Synonyms:Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate);5793-87-3;EINECS 227-333-6;DTXSID40973507;CALCIUM BIS(1,3,4,5-TETRAHYDROXYCYCLOHEXANE-1-CARBOXYLATE)

Chemical Property of Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate)

Chemical Property:

• Vapor Pressure: 1.58E-09mmHg at 25°C
• Boiling Point: 438.4°Cat760mmHg
• Flash Point: 233.1°C
• PSA: 242.10000
• Density: g/cm³
• LogP: -7.31220
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 0
• Exact Mass: 422.0737170
• Heavy Atom Count: 27
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(CC1(C(=O)[O-])O)O)O)O.C1C(C(C(CC1(C(=O)[O-])O)O)O)O.[Ca+2]

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