4,4a,5,6-Tetrahydro-7-methoxy-2(3H)-naphthalenone

Base Information

• Chemical Name: 4,4a,5,6-Tetrahydro-7-methoxy-2(3H)-naphthalenone
• CAS No.: 1614-84-2
• Molecular Formula: C₁₁H₁₄O₂
• Molecular Weight: 178.231
• DSSTox Substance ID: DTXSID901235112

Synonyms:1614-84-2;SCHEMBL123431;4,4a,5,6-Tetrahydro-7-methoxy-2(3H)-naphthalenone;DTXSID901235112;7-methoxy-3,4,4a,5,6-pentahydronaphthalen-2-one

Chemical Property of 4,4a,5,6-Tetrahydro-7-methoxy-2(3H)-naphthalenone

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 178.099379685
• Heavy Atom Count: 13
• Complexity: 287

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=CC(=O)CCC2CC1

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