Tert-butyl 5-methylsulfonyloxy-1,3-dihydroisoindole-2-carboxylate

Base Information

• Chemical Name: Tert-butyl 5-methylsulfonyloxy-1,3-dihydroisoindole-2-carboxylate
• CAS No.: 263888-59-1
• Molecular Formula: C₁₄H₁₉NO₅S
• Molecular Weight: 313.375
• DSSTox Substance ID: DTXSID701135079

Synonyms:263888-59-1;SCHEMBL6187723;CGXALRGYZHXVKB-UHFFFAOYSA-N;DTXSID701135079;DA-42987;2-(tert-Butyloxycarbonyl)-5-methanesulfonyloxy-2,3-dihydro-1H-isoindole;1,1-Dimethylethyl 1,3-dihydro-5-[(methylsulfonyl)oxy]-2H-isoindole-2-carboxylate

Chemical Property of Tert-butyl 5-methylsulfonyloxy-1,3-dihydroisoindole-2-carboxylate

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 313.09839388
• Heavy Atom Count: 21
• Complexity: 491

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CC2=C(C1)C=C(C=C2)OS(=O)(=O)C

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