Calcium diricinoleate

Base Information

• Chemical Name: Calcium diricinoleate
• CAS No.: 6865-33-4
• Molecular Formula: C18H34 O3 . 1/2 Ca
• Molecular Weight: 634.98
• European Community (EC) Number: 229-965-8
• UNII: X96M4UE2NZ
• DSSTox Substance ID: DTXSID301014673
• Mol file: 6865-33-4.mol

Synonyms:Calcium diricinoleate;6865-33-4;X96M4UE2NZ;9-Octadecenoic acid, 12-hydroxy-, calcium salt (2:1), (9Z,12R)-;EINECS 229-965-8;Ricinoleic acid, calcium salt (2:1);AI3-19722;calcium;(Z,12R)-12-hydroxyoctadec-9-enoate;9-Octadecenoic acid, 12-hydroxy-, calcium salt (2:1), [R-(Z)]-;9-Octadecenoic acid,12-hydroxy-, calcium salt (2:1), (9Z,12R)-;C18H34O3.1/2Ca;9-Octadecenoic acid, 12-hydroxy-, calcium salt (2:1), (R-(Z))-;C18-H34-O3.1/2Ca;UNII-X96M4UE2NZ;SCHEMBL315322;DTXSID301014673;9-Octadecenoic acid, 12-hydroxy-, calcium salt (2:1), (theta-(Z))-

Chemical Property of Calcium diricinoleate

Chemical Property:

• Vapor Pressure: 1.12E-08mmHg at 25°C
• Boiling Point: 416.4°C at 760 mmHg
• Flash Point: 219.8°C
• PSA: 93.06000
• LogP: 10.00440
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 28
• Exact Mass: 634.4485307
• Heavy Atom Count: 43
• Complexity: 256

Purity/Quality:

99.9% ^*data from raw suppliers

CALCIUM RICINOLEATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CC=CCCCCCCCC(=O)[O-])O.CCCCCCC(CC=CCCCCCCCC(=O)[O-])O.[Ca+2]
• Isomeric SMILES: CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)[O-].CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)[O-].[Ca+2]