Hydroxyjatrophone

Base Information

• Chemical Name: Hydroxyjatrophone
• CAS No.: 85201-83-8
• Molecular Formula: C20H24O4
• Molecular Weight: 328.4022
• NSC Number: 353456,353455,266490
• Mol file: 85201-83-8.mol

Synonyms:Hydroxyjatrophone;2-Hydroxyjatrophone;NSC353456;JATROPHONE,6-ISO;2.beta.-Hydroxyjatrophone;JATROPHONE, 2A-HYDROXY-;JATROPHONE, 2B-HYDROXY-;2.beta.-Hydroxy-5,6-isojatrophone;NSC266490;NSC353455;NSC-266490;NSC-353455;NSC-353456;85201-31-6;85201-83-8

Chemical Property of Hydroxyjatrophone

Chemical Property:

• Vapor Pressure: 1.97E-14mmHg at 25°C
• Boiling Point: 550.9°C at 760 mmHg
• Flash Point: 197.1°C
• PSA: 63.60000
• Density: 1.2g/cm³
• LogP: 3.18110
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 328.16745924
• Heavy Atom Count: 24
• Complexity: 763

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=CC(CC23C(=O)C(=C(O3)CC(C=CC1=O)(C)C)C)(C)O
• Isomeric SMILES: C/C/1=C/C2=CC(CC23C(=O)C(=C(O3)CC(/C=C\C1=O)(C)C)C)(C)O