Zeorin

Base Information

• Chemical Name: Zeorin
• CAS No.: 22570-53-2
• Molecular Formula: C30H52O2
• Molecular Weight: 444.742
• DSSTox Substance ID: DTXSID80945223
• Nikkaji Number: J11.494D
• Wikipedia: Zeorin
• Wikidata: Q27136451
• Metabolomics Workbench ID: 156626
• Mol file: 22570-53-2.mol

Synonyms:zeorin

Chemical Property of Zeorin

Chemical Property:

• Vapor Pressure: 8.7E-13mmHg at 25°C
• Melting Point: 253 °C
• Refractive Index: 1.521
• Boiling Point: 515.6 °C at 760 mmHg
• PKA: 14.98±0.70(Predicted)
• Flash Point: 206.4 °C
• PSA: 40.46000
• Density: 1.014 g/cm³
• LogP: 7.21960
• XLogP3: 8.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 444.396730897
• Heavy Atom Count: 32
• Complexity: 771

Purity/Quality:

98%min ^*data from raw suppliers

Zeorin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(CCCC2(C1C(CC3(C2CCC4C3(CCC5C4(CCC5C(C)(C)O)C)C)C)O)C)C
• Isomeric SMILES: C[C@]12CC[C@@H]([C@@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(C[C@@H]([C@@H]5[C@@]4(CCCC5(C)C)C)O)C)C)C(C)(C)O