6-(3-Methoxy-1-methyl-3-oxo-1-propenyl)-3-methyl-2-cyclohexene-1-carboxylic acid methyl ester

Base Information

• Chemical Name: 6-(3-Methoxy-1-methyl-3-oxo-1-propenyl)-3-methyl-2-cyclohexene-1-carboxylic acid methyl ester
• CAS No.: 123219-86-3
• Molecular Formula: C14H20 O4
• Molecular Weight: 252.31
• Nikkaji Number: J3.071.796A
• Mol file: 123219-86-3.mol

Synonyms:6-(3-methoxy-1-methyl-3-oxo-1-propenyl)-3-methyl-2-cyclohexene-1-carboxylic acid methyl ester;adozelesin;U 73975;U-73,975;U-73975

Chemical Property of 6-(3-Methoxy-1-methyl-3-oxo-1-propenyl)-3-methyl-2-cyclohexene-1-carboxylic acid methyl ester

Chemical Property:

• Vapor Pressure: 0.000225mmHg at 25°C
• Boiling Point: 325.8°Cat760mmHg
• Flash Point: 153.9°C
• PSA: 52.60000
• Density: 1.069g/cm³
• LogP: 2.25120
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 252.13615911
• Heavy Atom Count: 18
• Complexity: 393

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(C(CC1)C(=CC(=O)OC)C)C(=O)OC
• Isomeric SMILES: CC1=CC(C(CC1)/C(=C/C(=O)OC)/C)C(=O)OC
• Uses: Antineoplastic.

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