2-(1-Hydroxy-2-(1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-5-(hydroxymethyl)-1,2,4a-trimethyl-4-oxo-1-naphthalenyl)ethyl)-alpha-oxooxiraneacetaldehyde

Base Information

• Chemical Name: 2-(1-Hydroxy-2-(1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-5-(hydroxymethyl)-1,2,4a-trimethyl-4-oxo-1-naphthalenyl)ethyl)-alpha-oxooxiraneacetaldehyde
• CAS No.: 143200-52-6
• Molecular Formula: C20H28 O7
• Molecular Weight: 380.434
• DSSTox Substance ID: DTXSID90931778
• Nikkaji Number: J506.454F
• Wikidata: Q77508872
• Metabolomics Workbench ID: 106833
• Mol file: 143200-52-6.mol

Synonyms:UCT 4B;UCT-4B

Chemical Property of 2-(1-Hydroxy-2-(1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-5-(hydroxymethyl)-1,2,4a-trimethyl-4-oxo-1-naphthalenyl)ethyl)-alpha-oxooxiraneacetaldehyde

Chemical Property:

• Vapor Pressure: 5.31E-15mmHg at 25°C
• Boiling Point: 562.6°C at 760 mmHg
• Flash Point: 196°C
• PSA: 124.43000
• Density: 1.288g/cm³
• LogP: 0.19540
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 380.18350323
• Heavy Atom Count: 27
• Complexity: 700

Purity/Quality:

UCT 4B 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(=O)C2(C(C1(C)CC(C3(CO3)C(=O)C=O)O)CCC=C2CO)C)O