6-Chloro-5-(4'-hydroxycyclohexyl)indan-1-carboxylic acid

Base Information

• Chemical Name: 6-Chloro-5-(4'-hydroxycyclohexyl)indan-1-carboxylic acid
• CAS No.: 54423-58-4
• Molecular Formula: C16H19ClO3
• Molecular Weight: 294.7733
• DSSTox Substance ID: DTXSID80969560

Synonyms:6-chloro-5-(4'-hydroxycyclohexyl)indan-1-carboxylic acid

Chemical Property of 6-Chloro-5-(4'-hydroxycyclohexyl)indan-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 9.99E-10mmHg at 25°C
• Boiling Point: 472.3°Cat760mmHg
• Flash Point: 239.5°C
• Density: 1.334g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 294.1022722
• Heavy Atom Count: 20
• Complexity: 365

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(CCC1C2=C(C=C3C(CCC3=C2)C(=O)O)Cl)O
• Isomeric SMILES: C1CC2=CC(=C(C=C2[C@H]1C(=O)O)Cl)C3CCC(CC3)O

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