Cyclohexanebutanoicacid, calcium salt (2:1)

Base Information

• Chemical Name: Cyclohexanebutanoicacid, calcium salt (2:1)
• CAS No.: 110861-66-0
• Molecular Formula: C10H18 O2 . 1/2 Ca
• Molecular Weight: 378.56
• DSSTox Substance ID: DTXSID30911877
• Mol file: 110861-66-0.mol

Synonyms:Calcium cyclohexanebutyrate;110861-66-0;calcium;4-cyclohexylbutanoate;Cyclohexanebutanoicacid, calcium salt (2:1);Calcium bis(4-cyclohexylbutanoate);SCHEMBL2776319;DTXSID30911877;AKOS025294082;J-002483

Chemical Property of Cyclohexanebutanoicacid, calcium salt (2:1)

Chemical Property:

• Melting Point: 260 °C (dec.)(lit.)
• PSA: 80.26000
• LogP: 2.97380
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 378.2083004
• Heavy Atom Count: 25
• Complexity: 131

Purity/Quality:

99% ^*data from raw suppliers

Calcium cyclohexanebutyrate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Ca+2]