Pentanoic acid, 2-acetyl-5-iodo-2-methyl-, ethyl ester

Base Information

• Chemical Name: Pentanoic acid, 2-acetyl-5-iodo-2-methyl-, ethyl ester
• CAS No.: 105665-27-8
• Molecular Formula: C10H17IO3
• Molecular Weight: 312.14500
• DSSTox Substance ID: DTXSID50474232
• Nikkaji Number: J920.039H
• Mol file: 105665-27-8.mol

Synonyms:105665-27-8;Pentanoic acid, 2-acetyl-5-iodo-2-methyl-, ethyl ester;DTXSID50474232

Chemical Property of Pentanoic acid, 2-acetyl-5-iodo-2-methyl-, ethyl ester

Chemical Property:

• PSA: 43.37000
• LogP: 2.36000
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 312.02224
• Heavy Atom Count: 14
• Complexity: 215

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(C)(CCCI)C(=O)C

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